2665 SMILES Strings for Dihydroorotate dehydrogenase (quinone), mitochondrial
Compound Name
SMILES String
Brc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
Brc1ccc(NC(=O)C(C#N)C(=O)C2CC2)nc1
Brc1ccc(Nc2c3CCCCc3nc3ncnn23)cc1
Brc1ccc(cc1)-c1csc(N=NCc2ccccc2)n1 |w:11.11|
CC(=C)C(=O)C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
CC(=C)[C@@H](O)CC\C(C)=C\CC\C(C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
CC(=O)C(C#N)C(=O)Nc1ccc(c(Cl)c1)-c1cccc(Cl)c1
CC(=O)C(C#N)C(=O)Nc1ccc(c(Cl)c1)-c1ccccc1Cl
CC(=O)C(C#N)C(=O)Nc1ccc(cc1)-c1cccc(Cl)c1Cl
CC(=O)C(C#N)C(=O)Nc1ccc(cc1)-c1ccccc1
CC(=O)C(C#N)C(=O)Nc1ccc(cc1)-c1ccccc1Cl
CC(=O)C(C#N)C(=O)Nc1ccc(cc1)C#N
CC(=O)C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
CC(=O)C(C#N)C(=O)Nc1ccc(cc1C(F)(F)F)-c1cccc(Cl)c1
CC(=O)C(C#N)C(=O)Nc1ccc(cc1C(F)(F)F)-c1ccccc1Cl
CC(=O)C(C#N)C(=O)Nc1ccc(cc1Cl)-c1c(Cl)cccc1Cl
CC(=O)C(C#N)C(=O)Nc1ccc(cc1Cl)-c1cccc(Cl)c1
CC(=O)C(C#N)C(=O)Nc1ccc(cc1Cl)-c1cccc(Cl)c1Cl
CC(=O)C(C#N)C(=O)Nc1ccc(cc1Cl)-c1ccccc1
CC(=O)C(C#N)C(=O)Nc1ccc(cc1Cl)-c1ccccc1Cl
CC(=O)C(C#N)C(=O)Nc1ccccc1
CC(=O)C(C#N)C(=S)Nc1ccc(cc1)C(F)(F)F
CC(=O)N(c1cccc(c1)-c1ccccc1)c1nc2ccc(F)cc2c(C([O-])=O)c1C
CC(=O)Nc1cc(ccc1-c1ccccc1)-c1nc2c(cc(C)cc2[nH]1)C(O)=O
CC(=O)Nc1ccc(COc2ccc(cc2)-c2ccc(cc2)-c2nc3c(cc(C)cc3[nH]2)C(O)=O)cc1
CC(=O)Nc1ccc(cc1)-c1ccc(cc1)-c1nc2c(cc(C)cc2[nH]1)C(O)=O
CC(=O)Nc1ccc(cc1)-c1ccc(cc1)-c1nc2c(cccc2[nH]1)C(N)=O
CC(=O)Nc1ccc(cn1)-c1ccc(cc1)-c1nc2c(cccc2[nH]1)C(N)=O
CC(=O)Nc1ccc2nc(c(C)c(C(O)=O)c2c1)-c1ccc(cc1)-c1ccccc1
CC(=O)Nc1cccc(COc2ccc(cc2)-c2ccc(cc2)-c2nc3c(cc(C)cc3[nH]2)C(O)=O)c1
CC(=O)Nc1cccc(c1)-c1ccc(cc1)-c1cc(C(O)=O)c2n(C)nnc2c1
CC(=O)Nc1cccc(c1)-c1ccc(cc1)-c1nc2c(cc(C)cc2[nH]1)C(O)=O
CC(=O)Nc1cccc(c1)-c1ccc(cc1)-c1nc2c(cccc2[nH]1)C(N)=O
CC(=O)Nc1ccccc1-c1ccc(cc1)-c1nc2c(cc(C)cc2[nH]1)C(O)=O
CC(=O)Nc1ccccc1-c1ccc(cc1)-c1nc2c(cccc2[nH]1)C(N)=O
CC(=O)Nc1ccccc1COc1ccc(cc1)-c1ccc(cc1)-c1nc2c(cc(C)cc2[nH]1)C(O)=O
CC(=O)OCc1c(C)c(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccccc1
CC(=O)O[C@@H](CC\C(C)=C\CC\C(C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O)C(C)(C)O |r|
CC(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
CC(=O)c1sc(Nc2ccc(Br)c(c2)C(F)(F)F)nc1C
CC(=O)c1sc(Nc2ccc(Br)cc2)nc1C
CC(=O)c1sc(Nc2ccc(C)c(C)c2)nc1C
CC(=O)c1sc(Nc2ccc(C)c(Cl)c2)nc1C
CC(=O)c1sc(Nc2ccc(C)c(F)c2)nc1C
CC(=O)c1sc(Nc2ccc(Cl)c(c2)C(F)(F)F)nc1C
CC(=O)c1sc(Nc2ccc(cc2)C(C)(C)C)nc1C
CC(=O)c1sc(Nc2ccc3cc4ccccc4cc3c2)nc1C
CC(=O)c1sc(Nc2ccc3ccccc3c2)nc1C
CC(=O)c1sc(Nc2ccccc2)nc1C
CC(C)(C)C(=O)C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
CC(C)(C)C(=O)OCOC(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
CC(C)(C)C1=CC(=O)C=CC1=O |c:8,t:4|
CC(C)(C)CCC(=O)C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
CC(C)(C)c1ccc(NC(=O)c2cc3CCCCCc3cc2O)cc1
CC(C)(C)c1ccc(Oc2ccc(cc2)-c2cc(C(O)=O)c3cc(F)ccc3n2)cc1
CC(C)(C)c1ccc(cc1)-c1ccc(NC(=O)C2=C(CCC2)C(O)=O)cc1Cl |t:18|
CC(C)(C)c1ccc(cc1)-c1ccc(cc1)-c1cc(cc(c1)C(O)=O)C(N)=O
CC(C)(C)c1ccc(cc1)-c1cccc(c1)-c1cc(cc(c1)C(O)=O)C(N)=O
CC(C)(C)c1ccc(cc1)C(=O)Nc1cc2CCCCCc2cc1O
CC(C)(C)c1n[nH]c(Nc2ccc(cc2)C(F)(F)F)c1C#N
CC(C)(C)c1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1
CC(C)(C)c1oncc1C(=S)Nc1ccc(cc1)C#N
CC(C)(C)c1oncc1C(=S)Nc1ccc(cc1)C(F)(F)F
CC(C)C(=O)C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
CC(C)C1Cc2c(nnn2-c2cc(F)c(c(F)c2)-c2ccccc2F)C(=O)C1 |(28.37,-7.23,;29.71,-8,;29.7,-9.54,;31.04,-7.23,;32.38,-8.01,;33.72,-7.23,;33.73,-5.68,;35.2,-5.21,;36.11,-6.47,;35.19,-7.72,;35.66,-9.18,;34.62,-10.32,;35.09,-11.79,;34.06,-12.92,;36.6,-12.11,;37.63,-10.96,;39.14,-11.29,;37.16,-9.51,;37.07,-13.57,;36.03,-14.71,;36.5,-16.18,;38.01,-16.5,;39.04,-15.35,;38.57,-13.89,;39.6,-12.75,;32.38,-4.9,;32.38,-3.36,;31.04,-5.68,)|
CC(C)CCC1=C(O)C(=O)c2ccccc2C1=O |c:5|
CC(C)CNC(=O)c1cc(nn1-c1ccc(Cl)cc1)C(=O)NCc1ccccc1
CC(C)COc1ccc(cc1OCC(C)C)-c1cc(C(O)=O)c2ccccc2n1
CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCN(C)CC1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCNCC1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCOC1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCOCC1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)NCC(C)O)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)N[C@@H](C)CN)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)N[C@H](C)CN)-n1nc(C(C)C)n(C)c1=O
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cc[nH]n1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccn1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccncc1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccncn1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ncccn1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)C[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ncco1)-n1nc(C(C)C)n(C)c1=O |r|
CC(C)Cc1ccc(cc1)-c1cc(C(O)=O)c2ccccc2n1
CC(C)N(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CC(C)NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C
CC(C)NC(=O)c1ccc(s1)-n1cnc2ccccc12
CC(C)NCc1cccc(c1)-c1c(F)c(F)c(-c2cc(C(O)=O)c3nc(C)[nH]c3c2)c(F)c1F
CC(C)NCc1cccc(c1)-c1c(F)c(F)c(c(F)c1F)-c1cc(C(O)=O)c2n(C)nnc2c1
CC(C)OC(=O)OCOC(=O)c1ccccc1\C=N\N(C)c1nc(cs1)-c1ccccc1Cl
CC(C)OC(=O)OCOC(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
CC(C)OC(=O)c1cccc(c1)-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r|
CC(C)OC(=O)c1ccccc1\C=N\N(C)c1nc(cs1)-c1ccccc1Cl
CC(C)OC(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
CC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(c1)C(F)(F)F
CC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(Cl)cccc1Cl
CC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1Br
CC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1Cl
CC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1F
CC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1ccccc1Br
CC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1ccccc1Cl
CC(C)Oc1cc(Oc2ccccc2)c(C)cc1NC(=O)c1c(O)nn2ccccc12
CC(C)Oc1ccc(F)c(c1)-c1ccc(Nc2ccc(C)cc2C(O)=O)cn1
CC(C)Oc1ccc2n(c(C)nc2c1)-c1ccc(s1)C(=O)NC1CC1
CC(C)Oc1cccc(c1)-c1ncc(Nc2ccc(C)cc2C(O)=O)cc1C
CC(C)Oc1nn(c(C)c1C(O)c1ccccc1)-c1ncc(cn1)C1CC1
CC(C)Oc1nn(c(C)c1Cc1ccccc1F)-c1ncc(cn1)C1CC1
CC(C)Oc1nn(c(C)c1Oc1c(F)cccc1F)-c1ncc(cc1F)C1CC1
CC(C)[C@@H]1NC(=O)[C@@H]2CCCN2C1=O |r|
CC(C)\C=C\C1=C(O)C(=O)c2ccccc2C1=O |c:5|
CC(C)c1cc(-c2c(C)ccnc2Cl)c(=O)n2cc(F)c(cc12)-c1cn(C)c(n1)C(C)(C)O |(-3.5,2.52,;-2.17,1.75,;-.83,2.52,;-2.17,.21,;-3.5,-.56,;-3.5,-2.1,;-4.83,-2.87,;-6.17,-2.1,;-6.17,-.56,;-7.5,-2.87,;-7.5,-4.41,;-6.17,-5.18,;-4.83,-4.41,;-3.5,-5.18,;-2.17,-2.87,;-2.17,-4.41,;-.83,-2.1,;.5,-2.87,;1.83,-2.1,;3.17,-2.87,;1.83,-.56,;.5,.21,;-.83,-.56,;3.17,.21,;4.58,-.42,;5.61,.72,;7.14,.56,;4.84,2.06,;3.33,1.74,;5.46,3.47,;6.99,3.63,;6.37,2.22,;4.56,4.71,)|
CC(C)c1cc(-c2c(C)ccnc2Cl)c(=O)n2cc(F)c(cc12)-c1nc(n(C)n1)C(C)(C)O |(-3.5,2.52,;-2.17,1.75,;-.83,2.52,;-2.17,.21,;-3.5,-.56,;-3.5,-2.1,;-4.83,-2.87,;-6.17,-2.1,;-6.17,-.56,;-7.5,-2.87,;-7.5,-4.41,;-6.17,-5.18,;-4.83,-4.41,;-3.5,-5.18,;-2.17,-2.87,;-2.17,-4.41,;-.83,-2.1,;.5,-2.87,;1.83,-2.1,;3.17,-2.87,;1.83,-.56,;.5,.21,;-.83,-.56,;3.17,.21,;3.33,1.74,;4.84,2.06,;5.61,.72,;7.14,.56,;4.58,-.42,;5.46,3.47,;6.99,3.63,;6.37,2.22,;4.56,4.71,)|
CC(C)c1cc(-c2c(C)n[nH]c2C(F)(F)F)c(=O)n2cc(F)c(cc12)-c1cn(C)c(n1)C(C)(C)O |(-3.5,2.52,;-2.17,1.75,;-.83,2.52,;-2.17,.21,;-3.5,-.56,;-3.5,-2.1,;-4.83,-2.87,;-6.24,-2.25,;-6.56,-.74,;-7.27,-3.39,;-6.5,-4.73,;-5,-4.4,;-3.85,-5.44,;-4.17,-6.94,;-2.39,-4.96,;-2.71,-6.47,;-2.17,-2.87,;-2.17,-4.41,;-.83,-2.1,;.5,-2.87,;1.83,-2.1,;3.17,-2.87,;1.83,-.56,;.5,.21,;-.83,-.56,;3.17,.21,;4.58,-.42,;5.61,.72,;7.14,.56,;4.84,2.06,;3.33,1.74,;5.46,3.47,;6.99,3.63,;6.37,2.22,;4.56,4.71,)|
CC(C)c1cc(-c2c(C)n[nH]c2C(F)(F)F)c(=O)n2cc(F)c(cc12)-c1nc(n(C)n1)C(C)(C)O |(-3.5,2.52,;-2.17,1.75,;-.83,2.52,;-2.17,.21,;-3.5,-.56,;-3.5,-2.1,;-4.83,-2.87,;-6.24,-2.25,;-6.56,-.74,;-7.27,-3.39,;-6.5,-4.73,;-5,-4.4,;-3.85,-5.44,;-4.17,-6.94,;-2.39,-4.96,;-2.71,-6.47,;-2.17,-2.87,;-2.17,-4.41,;-.83,-2.1,;.5,-2.87,;1.83,-2.1,;3.17,-2.87,;1.83,-.56,;.5,.21,;-.83,-.56,;3.17,.21,;3.33,1.74,;4.84,2.06,;5.61,.72,;7.14,.56,;4.58,-.42,;5.46,3.47,;6.99,3.63,;6.37,2.22,;4.56,4.71,)|
CC(C)c1cc(-c2c(C)n[nH]c2Cl)c(=O)n2cc(F)c(cc12)-c1cn(C)c(n1)C(C)(C)O |(-3.5,2.52,;-2.17,1.75,;-.83,2.52,;-2.17,.21,;-3.5,-.56,;-3.5,-2.1,;-4.83,-2.87,;-6.24,-2.25,;-6.56,-.74,;-7.27,-3.39,;-6.5,-4.73,;-5,-4.4,;-3.85,-5.44,;-2.17,-2.87,;-2.17,-4.41,;-.83,-2.1,;.5,-2.87,;1.83,-2.1,;3.17,-2.87,;1.83,-.56,;.5,.21,;-.83,-.56,;3.17,.21,;4.58,-.42,;5.61,.72,;7.14,.56,;4.84,2.06,;3.33,1.74,;5.46,3.47,;6.99,3.63,;6.37,2.22,;4.56,4.71,)|
CC(C)c1cc(-c2c(C)n[nH]c2Cl)c(=O)n2cc(F)c(cc12)-c1nc(n(C)n1)C(C)(C)O |(-3.5,2.52,;-2.17,1.75,;-.83,2.52,;-2.17,.21,;-3.5,-.56,;-3.5,-2.1,;-4.83,-2.87,;-6.24,-2.25,;-6.56,-.74,;-7.27,-3.39,;-6.5,-4.73,;-5,-4.4,;-3.85,-5.44,;-2.17,-2.87,;-2.17,-4.41,;-.83,-2.1,;.5,-2.87,;1.83,-2.1,;3.17,-2.87,;1.83,-.56,;.5,.21,;-.83,-.56,;3.17,.21,;3.33,1.74,;4.84,2.06,;5.61,.72,;7.14,.56,;4.58,-.42,;5.46,3.47,;6.99,3.63,;6.37,2.22,;4.56,4.71,)|
CC(C)c1cc(-c2ccccc2C)c(=O)n2cc(F)c(cc12)-c1cn(C)c(n1)C(C)(C)O
CC(C)c1cc(NC(=O)c2c(O)nn3ccccc23)c(C)cc1Oc1ccccc1
CC(C)c1cc(Oc2ccc(cc2)C(F)(F)F)c(C)cc1NC(=O)c1c(O)nn2ccccc12
CC(C)c1cc(Oc2ccccc2)c(C)cc1NC(=O)c1c(O)nn2ccccc12
CC(C)c1cc(Oc2ccncc2)c(C)cc1NC(=O)c1c(O)nn2ccccc12
CC(C)c1cc(c(C)cc1Oc1ccccc1)-c1cc(C(O)=O)c2cc(F)ccc2n1
CC(C)c1ccc(Nc2c3CCCc3nc3ncnn23)cc1
CC(C)c1ccc(Nc2cc(C)nc3ncnn23)cc1
CC(C)c1ccc(cc1)-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O
CC(C)c1ccc(cc1)-c1cc(C(O)=O)c2ccccc2n1
CC(C)c1ccc(cc1)-c1cc(F)c(c(F)c1)-n1nnc2c1C(=O)c1ccccc1C2=O |(48.52,-52.45,;49.55,-51.31,;51.06,-51.63,;49.08,-49.84,;47.57,-49.52,;47.1,-48.06,;48.14,-46.92,;49.64,-47.24,;50.11,-48.69,;47.66,-45.45,;46.16,-45.13,;45.69,-43.66,;44.19,-43.34,;46.73,-42.52,;48.23,-42.85,;49.26,-41.7,;48.7,-44.31,;46.26,-41.06,;47.17,-39.81,;46.27,-38.55,;44.79,-39.02,;44.79,-40.57,;43.44,-41.35,;43.44,-42.89,;42.1,-40.57,;40.77,-41.34,;39.44,-40.57,;39.44,-39.03,;40.77,-38.26,;42.11,-39.02,;43.45,-38.24,;43.45,-36.7,)|
CC(C)c1ccc(cc1)-c1ccc(c(F)c1)-n1nnc2c1C(=O)c1ccccc1C2=O
CC(C)c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
CC(C)c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1
CC(C)c1cn(-c2c(C)ccnc2Cl)c(=O)c2cc(F)c(cc12)-c1cn(C)c(n1)C(C)(C)O |(-3.83,4.14,;-2.5,3.37,;-1.17,4.14,;-2.5,1.83,;-3.83,1.06,;-3.83,-.48,;-5.17,-1.25,;-5.17,-2.79,;-3.83,-3.56,;-6.5,-3.56,;-7.83,-2.79,;-7.83,-1.25,;-6.5,-.48,;-6.5,1.06,;-2.5,-1.25,;-2.5,-2.79,;-1.17,-.48,;.17,-1.25,;1.5,-.48,;2.83,-1.25,;1.5,1.06,;.17,1.83,;-1.17,1.06,;2.83,1.83,;4.17,1.06,;5.31,2.09,;6.82,1.77,;4.69,3.5,;3.16,3.34,;5.46,4.83,;7,4.83,;3.92,4.83,;4.69,6.17,)|
CC(C)c1cn(-c2c(C)ccnc2Cl)c(=O)c2cc(F)c(cc12)-c1nc(n(C)n1)C(C)(C)O |(-3.83,4.14,;-2.5,3.37,;-1.17,4.14,;-2.5,1.83,;-3.83,1.06,;-3.83,-.48,;-5.17,-1.25,;-5.17,-2.79,;-3.83,-3.56,;-6.5,-3.56,;-7.83,-2.79,;-7.83,-1.25,;-6.5,-.48,;-6.5,1.06,;-2.5,-1.25,;-2.5,-2.79,;-1.17,-.48,;.17,-1.25,;1.5,-.48,;2.83,-1.25,;1.5,1.06,;.17,1.83,;-1.17,1.06,;2.83,1.83,;3.16,3.34,;4.69,3.5,;5.31,2.09,;6.82,1.77,;4.17,1.06,;5.46,4.83,;7,4.83,;3.92,4.83,;4.69,6.17,)|
CC(C)c1cn(-c2c(C)n[nH]c2Cl)c(=O)c2cc(F)c(cc12)-c1cn(C)c(n1)C(C)(C)O |(-3.83,4.14,;-2.5,3.37,;-1.17,4.14,;-2.5,1.83,;-3.83,1.06,;-3.83,-.48,;-5.17,-1.25,;-5.33,-2.78,;-4.18,-3.81,;-6.83,-3.1,;-7.6,-1.77,;-6.57,-.62,;-6.89,.88,;-2.5,-1.25,;-2.5,-2.79,;-1.17,-.48,;.17,-1.25,;1.5,-.48,;2.83,-1.25,;1.5,1.06,;.17,1.83,;-1.17,1.06,;2.83,1.83,;4.17,1.06,;5.31,2.09,;6.82,1.77,;4.69,3.5,;3.16,3.34,;5.46,4.83,;7,4.83,;3.92,4.83,;4.69,6.17,)|
CC(C)c1cn(-c2c(C)n[nH]c2Cl)c(=O)c2cc(F)c(cc12)-c1nc(n(C)n1)C(C)(C)O |(-3.83,4.14,;-2.5,3.37,;-1.17,4.14,;-2.5,1.83,;-3.83,1.06,;-3.83,-.48,;-5.17,-1.25,;-5.33,-2.78,;-4.18,-3.81,;-6.83,-3.1,;-7.6,-1.77,;-6.57,-.62,;-6.89,.88,;-2.5,-1.25,;-2.5,-2.79,;-1.17,-.48,;.17,-1.25,;1.5,-.48,;2.83,-1.25,;1.5,1.06,;.17,1.83,;-1.17,1.06,;2.83,1.83,;3.16,3.34,;4.69,3.5,;5.31,2.09,;6.82,1.77,;4.17,1.06,;5.46,4.83,;7,4.83,;3.92,4.83,;4.69,6.17,)|
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1cc(N)c(C)cn1
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1ccc(C)c(N)n1
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1cn(C)c(CO)n1
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1cn(C)c(n1)C(C)(C)O
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1cn(C)c(n1)[C@@H](C)O |r|
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1cn(C)c(n1)[C@H](C)O |r|
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1cnc(cn1)C1CC1
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1nc(C(C)=O)n(C)n1
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1nc(C(C)O)n(C)n1
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1nc(CO)n(C)n1
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1nc([C@@H](C)O)n(C)n1 |r|
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1nc([C@H](C)O)n(C)n1 |r|
CC(C)c1cn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1nc(n(C)n1)C(C)(C)O
CC(C)c1cn(-c2nc(C)ccc2Cl)c(=O)c2cc(F)c(cc12)-c1cn(C)c(n1)C(C)(C)O
CC(C)c1n[nH]c(Nc2ccc(cc2)C(F)(F)F)c1C#N
CC(C)c1nc2nc(C)cc(Nc3ccc(cc3)C(F)(F)F)n2n1
CC(C)c1nc2nc(C)cc(Nc3ccc(cc3)S(F)(F)(F)(F)F)n2n1
CC(C)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c(=O)n1C |r|
CC(C)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
CC(C)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccccc2F)c(=O)n1C |r|
CC(C)c1nn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1cn(C)c(n1)C(C)(C)O
CC(C)c1nn(-c2ccccc2C)c(=O)c2cc(F)c(cc12)-c1cn(C)c(n1)[C@@H](C)O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c1=O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2cccc(c2)C(F)(F)F)c1=O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccccc2C)c1=O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccccc2F)c1=O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2c(C)cccc2F)c1=O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2cccc(c2)C(F)(F)F)c1=O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2ccccc2C)c1=O |r|
CC(C)n1c(C)nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2ccccc2F)c1=O |r|
CC(C)n1ccc2c(C(=O)OC22CCCCC2)c1=O
CC(CCCO)C(\C)=C(/C)CC\C(C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O
CC(CCN(C)C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc2COCCn2c1=O |w:1.0|
CC(CN1CCCC1)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc2COCCn2c1=O |w:1.0|
CC(CNC(=O)OC(C)(C)C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1Cl)-n1nc2CCCCn2c1=O |w:1.0|
CC(N=N)c1c(C)n[nH]c1Nc1ccc(cc1)C(F)(F)F
CC(NC(=O)c1[nH]c(C)c(Cc2ccc(nc2)C(F)(F)F)c1C#N)c1cc(C)on1
CC(NC(=O)c1[nH]c(C)c(Cc2ccc(nc2)C(F)(F)F)c1C)c1cc(C)on1
CC(NC(=O)c1[nH]c(C)c(Cc2ccc(nc2)C(F)(F)F)c1C)c1cn[nH]c1
CC(NC(=O)c1[nH]c(C)c(Cc2ccc(nc2)C(F)(F)F)c1C)c1cnn(C)c1
CC(NC(=O)c1[nH]c(C)c(Cc2ccc(nc2)C(F)(F)F)c1C)c1nc[nH]n1
CC(NC(=O)c1[nH]c(Cl)c(Cc2ccc(nc2)C(F)(F)F)c1C)c1nc[nH]n1
CC(NC(=O)c1[nH]cc(C(C#N)c2ccc(nc2)C(F)(F)F)c1C)c1cc(C)on1
CC(NC(=O)c1[nH]cc(C(C)c2ccc(nc2)C(F)(F)F)c1C)c1cc(C)on1
CC(NC(=O)c1[nH]cc(C(O)c2ccc(nc2)C(F)(F)F)c1C)c1cc(C)on1
CC(NC(=O)c1[nH]cc(Cc2ccc(F)c3ccncc23)c1C)c1cc(C)on1
CC(NC(=O)c1[nH]cc(Cc2ccc(F)c3ccncc23)c1C)c1nc[nH]n1
CC(NC(=O)c1[nH]cc(Cc2ccc(cc2)C(F)(F)F)c1C)c1cc(Br)no1
CC(NC(=O)c1[nH]cc(Cc2ccc(cc2)C(F)(F)F)c1C)c1cc(C)on1
CC(NC(=O)c1[nH]cc(Cc2ccc(cc2Br)C(F)(F)F)c1C)c1nc[nH]n1
CC(NC(=O)c1[nH]cc(Cc2ccc(cc2F)C(F)(F)F)c1C)c1nc[nH]n1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1c[nH]c(C)n1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1cc(Br)no1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1cc(C)[nH]n1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1cc(C)on1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1cc([nH]n1)C#N
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1cc([nH]n1)C(N)=O
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1cn[nH]c1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1cnn(C)c1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1n[nH]c(C)n1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1nc[nH]n1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C)c1noc(C)n1
CC(NC(=O)c1[nH]cc(Cc2ccc(nc2F)C(F)(F)F)c1C)c1nc[nH]n1
CC(NC(=O)c1[nH]cc(Cc2cccc3ccncc23)c1C)c1cc(C)on1
CC(NC(=O)c1[nH]cc(c1C)-c1c[nH]c2cc(F)ccc12)c1cc(C)on1
CC(NC(=O)c1[nH]cc(c1C)-c1c[nH]c2cc(ccc12)C(F)(F)F)c1cc(C)on1
CC(NC(=O)c1[nH]cc(c1C)-c1c[nH]c2nc(ccc12)C(F)(F)F)c1cc(C)on1
CC(NC(=O)c1[nH]cc(c1C)-c1n[nH]c2cc(ccc12)C(F)(F)F)c1cc(C)on1
CC(NC(=O)c1[nH]cc(c1C)-c1n[nH]c2nc(ccc12)C(F)(F)F)c1cc(C)on1
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1ccc(c(F)c1)C(F)(F)F)c1nc[nH]n1
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1ccc(c(c1)C#N)C(F)(F)F)c1nc[nH]n1
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1ccc(nc1)C(F)(F)F)c1c[nH]cn1
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1ccc(nc1)C(F)(F)F)c1cc(C)[nH]n1
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1ccc(nc1)C(F)(F)F)c1cc(C)on1
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1ccc(nc1)C(F)(F)F)c1cc([nH]n1)C#N
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1ccc(nc1)C(F)(F)F)c1cc([nH]n1)C(N)=O
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1ccc(nc1)C(F)(F)F)c1cn[nH]c1
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1ccc(nc1)C(F)(F)F)c1nc[nH]n1
CC(NC(=O)c1[nH]cc(c1C)C1(CC1)c1cccc(c1)C(F)(F)F)c1nc[nH]n1
CC(O)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
CC(O)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccccc2C)c(=O)n1C |r,w:1.1|
CC(Oc1cc(NC(=O)N(C)C(=N)[C@@H](C)N(Cc2ccccc2)Cc2ccccc2)c(F)cc1C(=O)Nc1ccc(N)cc1C)C1CCCCC1 |r|
CC(Oc1cc(c(F)cc1C(=O)Nc1ccc(N)cc1C)-n1nc([C@@H](C)N(Cc2ccccc2)Cc2ccccc2)n(C)c1=O)C1CCCCC1 |r|
CC(Oc1cc(ccc1C(=O)Nc1c(F)cccc1Cl)-n1nc(n(C)c1=O)C(C)(C)O)C(F)F |w:1.0|
CC1(C)Cc2c(nnn2-c2cc(F)c(c(F)c2)-c2ccccc2F)C(=O)C1 |(5.38,-9.63,;6.71,-8.86,;6.7,-10.4,;8.05,-9.64,;9.39,-8.87,;9.4,-7.32,;10.87,-6.84,;11.78,-8.1,;10.86,-9.35,;11.33,-10.81,;10.3,-11.95,;10.76,-13.42,;9.73,-14.55,;12.27,-13.74,;13.3,-12.59,;14.81,-12.92,;12.83,-11.14,;12.74,-15.2,;11.71,-16.34,;12.18,-17.81,;13.68,-18.13,;14.72,-16.98,;14.24,-15.52,;15.27,-14.38,;8.05,-6.53,;8.05,-4.99,;6.71,-7.31,)|
CC1(C)OC(=O)c2c1ccn(C1CC1)c2=O
CC1(C)OC(=O)c2c1ccnc2O
CC1(OC(=O)c2c1ccn(C1CC1)c2=O)c1ccccc1
CC1=C(C(=O)NC2CC2)C(=O)OC11CCCCC1 |c:1|
CC1=C(OC2C=CC=CC12)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1C |r,c:5,7,t:1|
CC1=CC(=O)C=CC1=O |c:5,t:1|
CC=CC(=O)C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F |w:1.0|
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2cc(F)c(F)c(F)c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2ccc(Cl)cc2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2ccc(F)c(F)c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2ccc(F)cc2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2ccc(F)nc2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2ccc3OCCOc3c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2ccc3OCOc3c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2cccc(Cl)c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2cccc(F)c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2cccc(OC(F)(F)F)c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2cccc(OC(F)F)c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2cccc(OC)c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2cccc(OC3CCC3)c2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2ccccc2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(-c2cccnc2)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(OS(=O)(=O)C(F)(F)F)c(c1)C(=O)OC
CCC(=O)C(C#N)C(=O)Nc1ccc(OS(=O)(=O)C(F)(F)F)cc1
CCC(=O)C(C#N)C(=O)Nc1ccc(c(c1)C(=O)OC)-c1ccc(F)cc1C
CCC(=O)C(C#N)C(=O)Nc1ccc(c(c1)C(=O)OC)-c1ccc(F)cc1F
CCC(=O)C(C#N)C(=O)Nc1ccc(c(c1)C(=O)OC)-c1ccc(F)cc1OC
CCC(=O)C(C#N)C(=O)Nc1ccc(c(c1)C(=O)OC)-c1ccccc1Cl
CCC(=O)Nc1ccc(cc1C(O)=O)N(C)Cc1cccnc1
CCC(C)N(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CCC(C)Nc1nccc(n1)-c1cnc2sc(C)cn2c1=O
CCC(C)OC(=O)c1ccccc1\C=N\N(C)c1nc(cs1)-c1ccccc1Cl
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cc(F)cc(F)c1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cc2ccccc2o1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccc(Cl)cc1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccc(F)c(F)c1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccc(F)cc1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccc(OC)cc1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccc2OCOc2c1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccc2ccccc2c1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(Cl)c1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(Cl)c1C
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(F)c1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(F)c1C
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(OC(F)(F)F)c1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(OC)c1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(c1)C(F)(F)F
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc2ccccc12
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccccc1
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccccc1C
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccccc1Cl
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccccc1F
CCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1ccnc(F)c1
CCC(C)Oc1cc(Oc2ccccc2)c(C)cc1NC(=O)c1c(O)nn2ccccc12
CCC(C)c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1
CCC(C)c1cn(-c2c(F)cccc2Cl)c(=O)c2cc(F)c(cc12)-n1nc(CO)n(CC)c1=O |(-.95,4.29,;-.95,2.75,;-2.29,1.98,;-3.62,2.75,;-2.29,.44,;-3.62,-.33,;-3.62,-1.87,;-4.95,-2.64,;-4.95,-4.18,;-3.62,-4.95,;-6.29,-4.95,;-7.62,-4.18,;-7.62,-2.64,;-6.29,-1.87,;-6.29,-.33,;-2.29,-2.64,;-2.29,-4.18,;-.95,-1.87,;.38,-2.64,;1.71,-1.87,;3.05,-2.64,;1.71,-.33,;.38,.44,;-.95,-.33,;3.05,.44,;3.21,1.97,;4.71,2.29,;5.34,3.7,;4.44,4.95,;5.48,.96,;7.02,.8,;7.62,-.62,;4.45,-.18,;4.77,-1.69,)|
CCC(C)c1nc2nc(C)cc(Nc3ccc(cc3)C(F)(F)F)n2n1
CCC(C)c1nc2nc(C)cc(Nc3ccc(cc3)S(F)(F)(F)(F)F)n2n1
CCC(C)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
CCC(C)n1c(C)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O |r|
CCC(CC#N)NC(=O)c1cc(F)c(cc1O[C@@H](C)c1ccccc1)-n1nc(CC)n(C)c1=O |r|
CCC(CC)NC(=O)c1cc(F)c(cc1OC(C)C(CC)CC)-n1nc(CC)n(C)c1=O
CCC(CC)NC(=O)c1cc(F)c(cc1OC(C)C1CC1)-n1nc(CC)n(C)c1=O
CCC(CC)NC(=O)c1cc(F)c(cc1OC(C)C1CCC1)-n1nc(CC)n(C)c1=O
CCC(CC)NC(=O)c1cc(F)c(cc1OC(C)C1CCCC1)-n1nc(CC)n(C)c1=O
CCC(CC)NC(=O)c1cc(F)c(cc1OC(C)CC1CC1)-n1nc(CC)n(C)c1=O
CCC(CC)NC(=O)c1cc(F)c(cc1OC(C)CC=C)-n1nc(CC)n(C)c1=O
CCC(CC)NC(=O)c1cc(F)c(cc1OC(C)c1ccccc1)-n1nc(CC)n(C)c1=O
CCC(CC)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(OC)c1
CCC(CC)Oc1cc(Oc2ccccc2)c(C)cc1NC(=O)c1c(O)nn2ccccc12
CCC(CC)n1cc(C(C)C)c2cc(c(F)cc2c1=O)-n1nc(CO)n(CC)c1=O
CCC(COC)n1cc(C(C)C)c2cc(c(F)cc2c1=O)-n1nc(CO)n(CC)c1=O
CCC(Cc1ccccc1)NC(=O)c1cc(F)c(cc1O[C@@H](C)C1CCCCC1)-n1nc(CC)n(C)c1=O |r|
CCC(F)(F)c1nc2nc(C)cc(Nc3ccc(Cl)cc3)n2n1
CCC(F)(F)c1nc2nc(C)cc(Nc3ccc(cc3)C(F)(F)F)n2n1
CCC(F)(F)c1nc2nc(C)cc(Nc3ccc(cc3)S(F)(F)(F)(F)F)n2n1
CCC(F)(F)c1nc2nc(C)cc(Nc3cccc(Cl)c3)n2n1
CCC1(C)OC(=O)c2c1ccn(C1CC1)c2=O
CCC1(CC)OC(=O)c2c1ccn(C1CC1)c2=O
CCCC(=O)c1[nH]cc(Cc2ccc(nc2)C(F)(F)F)c1C
CCCC(C)N(\N=C\c1ccccc1C(O)=O)c1nc(c(C)s1)-c1ccccc1Cl
CCCC(C)N(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CCCC(C)Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(OC)c1
CCCC(C)Oc1cc(Oc2ccccc2)c(C)cc1NC(=O)c1c(O)nn2ccccc12
CCCC(C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc([C@H](C)O)n(C)c1=O
CCCCC(=O)c1ccc(s1)-n1cnc2ccccc12
CCCCC(N=O)c1ccc(s1)-n1cnc2ccccc12
CCCCC(O)c1ccc(s1)-n1cnc2ccccc12
CCCCCC1CCCc2c(O)c3ccccc3nc12
CCCCCCCCCCCCc1cc(=O)c2ccccc2n1O
CCCCCCCCc1ccc(Nc2cc(C)nc3ncnn23)cc1
CCCCCCCNc1cc(C)nc2ncnn12
CCCCCCCc1ccc(Nc2cc(C)nc3ncnn23)cc1
CCCCCCNC(=O)COc1ccc(cc1OC)-c1cc(C(O)=O)c2ccccc2n1
CCCCCCOC(=O)c1ccccc1\C=N\N(C)c1nc(cs1)-c1ccccc1Cl
CCCCCCOC(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
CCCCCC[C@@H]1[C@@H](OC(=O)CC(C)C)[C@H](C)OC(=O)[C@@H](NC(=O)c2cccc(NC=O)c2O)[C@@H](C)OC1=O |r|
CCCCCCc1ccc(Nc2cc(C)nc3ncnn23)cc1
CCCCCCc1ccc(cc1)-c1nc2ccc(F)cc2c(C(O)=O)c1C
CCCCCCc1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1
CCCCCCc1oncc1C(=S)Nc1ccc(cc1)C#N
CCCCCCc1oncc1C(=S)Nc1ccc(cc1)C(F)(F)F
CCCCCCc1oncc1C(=S)Nc1ccc(cc1)N(C)C
CCCCCOC(=O)c1ccccc1\C=N\N(C)c1nc(cs1)-c1ccccc1Cl
CCCCCOC(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
CCCCCc1ccc(Nc2cc(C)nc3ncnn23)cc1
CCCCNC(=O)c1[nH]c(C)c(Cc2ccc(cc2)C(F)(F)F)c1C
CCCCNC(=O)c1c(O)csc1Nc1ccc(C)c(C)c1
CCCCNC(=O)c1c(O)csc1Nc1ccc2ccccc2c1
CCCCNC(=O)c1ccc(s1)-n1cnc2ccccc12
CCCCOC(=O)c1c(O)csc1Nc1ccc(C)c(C)c1
CCCCOC(=O)c1c(O)csc1Nc1ccc2ccccc2c1
CCCCOC(=O)c1ccccc1\C=N\N(C)c1nc(cs1)-c1ccccc1Cl
CCCCOC(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
CCCC\C(=N/OC)c1ccc(s1)-n1cnc2ccccc12
CCCC\C(=N\OC)c1ccc(s1)-n1cnc2ccccc12
CCCCc1ccc(Nc2cc(C)nc3ncnn23)cc1
CCCCc1ccc(nc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(C)cc1 |r|
CCCN(C)C(=O)c1ccc(s1)-n1cnc2ccccc12
CCCN(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CCCNC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1ccc(c(c1)C(F)(F)F)C(F)(F)F |r|
CCCNC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C#Cc1cccc(F)c1
CCCNC(=O)c1[nH]c(C)c(Cc2ccc(cc2)C(F)(F)F)c1C
CCCNC(=O)c1[nH]c(C)c(Cc2ccc(nc2)C(F)(F)F)c1C
CCCNC(=O)c1c(O)csc1Nc1ccc(C)c(C)c1
CCCNC(=O)c1c(O)csc1Nc1ccc2ccccc2c1
CCCNC(=O)c1ccc(s1)-n1c(C)cc2ccccc12
CCCNC(=O)c1ccc(s1)-n1c(C)nc2cc(Cl)ccc12
CCCNC(=O)c1ccc(s1)-n1c(C)nc2cc(F)ccc12
CCCNC(=O)c1ccc(s1)-n1c(C)nc2ccccc12
CCCNC(=O)c1ccc(s1)-n1cccn1
CCCNC(=O)c1ccc(s1)-n1ccnc1
CCCNC(=O)c1ccc(s1)-n1cnc2cc(Cl)ccc12
CCCNC(=O)c1ccc(s1)-n1cnc2ccccc12
CCCNC(=O)c1ccc(s1)N1CC(C)Sc2ccccc12
CCCNC(=O)c1ccc(s1)N1CCCC1
CCCNC(=O)c1ccc(s1)N1CCCCC1
CCCNC(=O)c1ccc(s1)N1CCN(C)CC1
CCCNC(=O)c1ccc(s1)N1CCOCC1
CCCNC(=O)c1ccc(s1)N1CCOc2ccc(Cl)cc12
CCCNC(=O)c1ccc(s1)N1CCSc2ccccc12
CCCNC(=O)c1ccc(s1)N1CCSc2ncccc12
CCCNC(=O)c1ccc(s1)N1CCc2ccccc12
CCCNC(=O)c1ccc(s1)N1Cc2cccc(OC)c2Oc2ncccc12
CCCNC(=S)c1ccc(s1)-n1ccc2ccccc12
CCCOC(=O)c1c(O)csc1Nc1ccc(C)c(C)c1
CCCOC(=O)c1c(O)csc1Nc1ccc2ccccc2c1
CCCOC(=O)c1ccccc1\C=N\N(C)c1nc(cs1)-c1ccccc1Cl
CCCOC(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
CCCOc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(OC)c1
CCCOc1ccc(cc1)-c1cc(C(O)=O)c2cc(Cl)ccc2n1
CCCOc1cccc(c1)-c1c(F)c(F)c(NC(=O)c2c(O)nn3ccccc23)c(F)c1F
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC(C)C1CCCCC1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC(CC)CC)-n1nc(C(C)O)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC(CC)CC)-n1nc(CO)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC(CC)CC)-n1nc(n(C)c1=O)C(C)(C)O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCCCCC1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCN(C)C(=O)C1)-n1nc2CCCCn2c1=O |r,w:16.16|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCN(C)CC1)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCN(CC1)C(=O)C1CC1)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCN(CC1)C(C)=O)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCN(CC1)S(C)(=O)=O)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC1CCN(CC1)c1cnccn1)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NC1Cc2ccccc2C1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NCC(C)(C)C)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NCC1CCCC1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)NCC1CCCCC1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)N[C@H](C)CO)-n1nc(C(C)C)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)N[C@H](CC)C(N)=O)-n1nc(C(C)C)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)N[C@H](CC)CO)-n1nc(C(C)C)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cc(C)cc1N)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cc(N)cc1C)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cc(N)cc1N)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1C(F)(F)F)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1CN)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc(C)n(C(C)C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc(CO)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc([C@H](C)O)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc(n(C)c1=O)C(C)(C)O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc2ccccn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1N)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)ccnc1OC)-n1nc(CO)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)ccnc1OC)-n1nc([C@H](C)O)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)ccnc1OC)-n1nc(n(C)c1=O)C(C)(C)O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)ccnc1OC)-n1nc(n(C)c1=O)C(C)(O)O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)ccnc1OC)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1Cl)-n1nc(CO)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1Cl)-n1nc([C@H](C)O)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1Cl)-n1nc(n(C)c1=O)C(C)(C)O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1Cl)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1Cl)-n1nc2COCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1F)-n1nc(C)n(C(C)C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1F)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1F)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1F)-n1nc2ccccn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cc(F)ccc1C)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccc(C)cc1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccc(CC)cc1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccc(CN)c(C)c1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1C)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccc(N)cc1C)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccc(OC)cc1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccc(cc1)C(C)C)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccc(cc1)C(F)(F)F)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cccc(C)c1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cccc(N)c1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cccc(N)c1C)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cccc(OC)c1)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cccc(c1)C(F)(F)F)-n1nc(C)n(C(C)C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cccc(c1)C(F)(F)F)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cccc(c1)C(F)(F)F)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cccc(c1)C(F)(F)F)-n1nc2ccccn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C(C)C)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C(F)(F)F)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C(F)F)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(C(C)O)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(C)n(C(C)C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(CN)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc2ccccn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1CC)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1CCC)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc(C)n(C(C)C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc2ccccn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1N)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1NC)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1NC)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1O)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1OC)-n1nc(CC)n(C)c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccncc1Cl)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cnc(OC)cc1C)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cnc(OC)cc1C)-n1nc2COCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1cnccc1C)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ncc(C)nc1C)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ncccc1Cl)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ncncc1C)-n1nc2CCCCn2c1=O |r|
CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ncncc1Cl)-n1nc2CCCCn2c1=O |r|
CCCc1c(C)nc2ncnn2c1Nc1ccc(C)cc1
CCCc1ccc(Nc2cc(C)nc3ncnn23)cc1
CCCc1nc2ccccc2n1-c1ccc(s1)C(=O)NC1CC1
CCCc1nc2ccccc2n1-c1ccc(s1)C(=O)NCC
CCCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
CCCn1c(C)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O |r|
CCCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)ccnc2O)c1=O |r|
CCCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)ccnc2OC)c1=O |r|
CCCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O |r|
CCCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O)C(O)=O |r|
CCN(C)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
CCN(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CCN1CC(C1)NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2CCCCn2c1=O |r|
CCNC(=O)Nc1ccc(cc1)S(=O)(=O)Oc1ccccc1CC
CCNC(=O)c1[nH]c(C)c(Cc2ccc(cc2)C(F)(F)F)c1C
CCNC(=O)c1[nH]c(C)c(Cc2ccc(nc2)C(F)(F)F)c1C
CCNC(=O)c1c(O)csc1Nc1ccc(C)c(C)c1
CCNC(=O)c1c(O)csc1Nc1ccc2ccccc2c1
CCNC(=O)c1ccc(cc1)-n1c(C)nc2cc(F)ccc12
CCNC(=O)c1ccc(s1)-n1c(C)nc2cc(C)ccc12
CCNC(=O)c1ccc(s1)-n1c(C)nc2cc(Cl)ccc12
CCNC(=O)c1ccc(s1)-n1c(C)nc2cc(F)ccc12
CCNC(=O)c1ccc(s1)-n1c(C)nc2ccccc12
CCNC(=O)c1ccc(s1)-n1c(CC)nc2cc(F)ccc12
CCNC(=O)c1ccc(s1)-n1c(CC)nc2ccccc12
CCNC(=O)c1ccc(s1)-n1cc(nc1C)-c1ccccc1
CCNC(=O)c1ccc(s1)-n1cnc2cc(C)ccc12
CCNC(=O)c1ccc(s1)-n1cnc2cc(Cl)ccc12
CCNC(=O)c1ccc(s1)-n1cnc2cc(F)ccc12
CCNC(=O)c1ccc(s1)-n1cnc2ccccc12
CCNC(=O)c1cccc(c1)-n1c(C)nc2cc(F)ccc12
CCNc1n[nH]c(Nc2ccc(cc2)C(F)(F)F)c1C#N
CCOC(=O)C(=C/Nc1ccc2n(CC)c3ccccc3c2c1)\C#N
CCOC(=O)C(=C/Nc1ccc2sc3ccccc3c2c1)\[N+]([O-])=O
CCOC(=O)C(=C\Nc1ccc2n(CC)c3ccccc3c2c1)\[N+]([O-])=O
CCOC(=O)C(C=Nc1ccc(C)cc1)C(=O)OCC |w:7.7|
CCOC(=O)C(C=Nc1ccc(cc1)-c1ccccc1)C#N |w:7.7|
CCOC(=O)C(C=Nc1ccc(cc1)-c1ccccc1)C(=O)OCC |w:7.7|
CCOC(=O)C(C=Nc1ccc2n(CC)c3ccccc3c2c1)C#N |w:7.7|
CCOC(=O)C(C=Nc1ccc2n[nH]cc2c1)C(=O)OCC |w:7.7|
CCOC(=O)C(C=Nc1ccc2nc[nH]c2c1)C(=O)OCC |w:7.7|
CCOC(=O)C(C=Nc1ccc2sc3ccccc3c2c1)C(=O)OCC |w:7.7|
CCOC(=O)C(C=Nc1cccc(c1)-c1ccccc1)C#N |w:7.7|
CCOC(=O)C(C=Nc1cccc(c1)-c1ccccc1)C(=O)OCC |w:7.7|
CCOC(=O)C(C=Nc1ccccc1C)C(=O)OCC |w:7.7|
CCOC(=O)c1[nH]c(C)c(Cc2cc(OC)cc(OC)c2)c1C
CCOC(=O)c1[nH]c(C)c(Cc2ccc(OC)cc2)c1C
CCOC(=O)c1[nH]c(C)c(Cc2ccc(OCC)cc2)c1C
CCOC(=O)c1[nH]c(C)c(Cc2ccc(cc2)C(C)C)c1C
CCOC(=O)c1[nH]c(C)c(Cc2ccc(cc2)C(F)(F)F)c1C
CCOC(=O)c1[nH]c(C)c(Cc2ccc(cn2)C(F)(F)F)c1C
CCOC(=O)c1[nH]c(C)c(Cc2ccc(nc2)C(F)(F)F)c1C
CCOC(=O)c1[nH]c(C)c(Cc2cccc(OCC)c2)c1C
CCOC(=O)c1[nH]cc(Cc2ccc(c3ncoc23)C(F)(F)F)c1C
CCOC(=O)c1[nH]cc(Cc2ccc(cc2)C(F)(F)F)c1C
CCOC(=O)c1[nH]cc(Cc2ccc(cc2Cl)C(F)(F)F)c1C
CCOC(=O)c1[nH]cc(Cc2ccc(cc2F)C(F)(F)F)c1C
CCOC(=O)c1[nH]cc(Cc2cccc3ncoc23)c1C
CCOC(=O)c1[nH]cc(Cc2nc3ccccc3o2)c1C
CCOC(=O)c1c(C)n[nH]c1Nc1ccc(cc1)C(F)(F)F
CCOC(=O)c1c(O)c2cc(F)c(OC)cc2nc1-c1ccc2OCOc2c1
CCOC(=O)c1c(O)c2cc(F)c(OC)cc2nc1-c1cccc(Cl)c1
CCOC(=O)c1c(O)c2cc(F)c(OC)cc2nc1-c1cccc(Oc2ccccc2)c1
CCOC(=O)c1c(O)c2ccc(OC)cc2nc1-c1cccc(F)c1
CCOC(=O)c1c(O)coc1Nc1ccc(C)c(C)c1
CCOC(=O)c1c(O)coc1Nc1ccc(cc1)C(F)(F)F
CCOC(=O)c1c(O)coc1Nc1ccc(cc1)S(F)(F)(F)(F)F
CCOC(=O)c1c(O)coc1Nc1ccc2CCCCc2c1
CCOC(=O)c1c(O)coc1Nc1ccc2CCCc2c1
CCOC(=O)c1c(O)coc1Nc1ccc2ccccc2c1
CCOC(=O)c1c(O)coc1Nc1cnc2ccccc2c1
CCOC(=O)c1c(O)csc1Nc1cc(Cl)cc(Cl)c1
CCOC(=O)c1c(O)csc1Nc1ccc(Br)c(c1)C(F)(F)F
CCOC(=O)c1c(O)csc1Nc1ccc(Br)cc1C
CCOC(=O)c1c(O)csc1Nc1ccc(C)c(C)c1
CCOC(=O)c1c(O)csc1Nc1ccc(C)c(F)c1
CCOC(=O)c1c(O)csc1Nc1ccc(Cl)c(c1)C(F)(F)F
CCOC(=O)c1c(O)csc1Nc1ccc(cc1)C(C)(C)C
CCOC(=O)c1c(O)csc1Nc1ccc(cc1)C(F)(F)F
CCOC(=O)c1c(O)csc1Nc1ccc(cc1)S(F)(F)(F)(F)F
CCOC(=O)c1c(O)csc1Nc1ccc2CCCCc2c1
CCOC(=O)c1c(O)csc1Nc1ccc2CCCc2c1
CCOC(=O)c1c(O)csc1Nc1ccc2cc3ccccc3cc2c1
CCOC(=O)c1c(O)csc1Nc1ccc2ccccc2c1
CCOC(=O)c1c(O)csc1Nc1ccc2n(CC)c3ccccc3c2c1
CCOC(=O)c1c(O)csc1Nc1cccc(c1)C(F)(F)F
CCOC(=O)c1c(O)csc1Nc1ccccc1
CCOC(=O)c1c(O)csc1Nc1cnc2ccccc2c1
CCOC(=O)c1c(O)nn(C)c1COc1ccccc1
CCOC(=O)c1cccc(c1)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12
CCOC(=O)c1ccccc1\C=N\N(C)c1nc(cs1)-c1ccccc1Cl
CCOC(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
CCOC(=O)c1sc(Nc2c(F)cc(cc2F)-c2cccc(OC)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2cc(Cl)cc(Cl)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(Br)c(c2)C(F)(F)F)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(Br)cc2)nc1C
CCOC(=O)c1sc(Nc2ccc(Br)cc2C)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(C)c(C)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(C)c(C)c2)nc1C
CCOC(=O)c1sc(Nc2ccc(C)c(C)c2)nc1C(C)(C)C
CCOC(=O)c1sc(Nc2ccc(C)c(C)c2)nc1C1CC1
CCOC(=O)c1sc(Nc2ccc(C)c(C)c2)nc1N
CCOC(=O)c1sc(Nc2ccc(C)c(C)c2)nc1NC(=O)C1CC1
CCOC(=O)c1sc(Nc2ccc(C)c(C)c2)nc1NC(=O)c1ccccc1
CCOC(=O)c1sc(Nc2ccc(C)c(Cl)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(C)c(Cl)c2)nc1C
CCOC(=O)c1sc(Nc2ccc(C)c(Cl)c2)nc1C(C)(C)C
CCOC(=O)c1sc(Nc2ccc(C)c(Cl)c2)nc1C1CC1
CCOC(=O)c1sc(Nc2ccc(C)c(F)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(C)c(F)c2)nc1C
CCOC(=O)c1sc(Nc2ccc(C)c(F)c2)nc1C(C)(C)C
CCOC(=O)c1sc(Nc2ccc(C)c(F)c2)nc1C1CC1
CCOC(=O)c1sc(Nc2ccc(Cl)c(Cl)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(Cl)c(c2)C(F)(F)F)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(Cl)c(c2)C(F)(F)F)nc1N
CCOC(=O)c1sc(Nc2ccc(Cl)c(c2)C(F)(F)F)nc1NC(=O)C1CC1
CCOC(=O)c1sc(Nc2ccc(Cl)c(c2)C(F)(F)F)nc1NC(=O)c1ccccc1
CCOC(=O)c1sc(Nc2ccc(Cl)cc2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(OC)cc2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(OCc3c(F)cccc3Cl)c(Cl)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(OCc3ccccc3)c(Cl)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(Oc3ccccc3)c(Cl)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(cc2)-c2cccc(OC)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(cc2)-c2ccccc2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(cc2)C(C)(C)C)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(cc2)C(F)(F)F)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(cc2F)-c2cccc(OC)c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc(cc2F)-c2ccccc2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc3CCCCc3c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc3CCCc3c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc3OCOc3c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc3cc4ccccc4cc3c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc3ccccc3c2)nc1-c1ccccc1
CCOC(=O)c1sc(Nc2ccc3ccccc3c2)nc1C
CCOC(=O)c1sc(Nc2ccccc2)nc1-c1ccccc1
CCONC(=O)c1c(C)c(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccccc1F
CCOc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1-c1cccc(OC)c1
CCOc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(Cl)cccc1Cl
CCOc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1Br
CCOc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1Cl
CCOc1ccc(F)c(c1)-c1ccc(Nc2ccc(C)cc2C(O)=O)cn1
CCOc1ccc2nc(C(=O)Nc3c(F)cc(cc3F)-c3cccc(F)c3)c(C)c(C(O)=O)c2c1
CCOc1cccc(=O)c2c(C)n(Cc3ccc(Cl)cc3)c(C)c12
CCOc1cccc(c1)-c1cc(C)c(Nc2ccc(C)cc2C(O)=O)cn1
CCOc1cccc(c1)-c1cc(F)c(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1 |t:18|
CCOc1cccc(c1)-c1cc(F)c(Nc2ncc(cc2C(O)=O)C2CC2)cc1F
CCOc1cccc(c1)-c1cc(F)c(Nc2ncccc2C(O)=O)c(F)c1
CCOc1cccc(c1)-c1ccc(NC(=O)C(C#N)C(=O)CC)cc1C(=O)OC
CCOc1cccc(c1)-c1ccc(NC(=O)C(C#N)C(C)=O)cc1
CCOc1cccc(c1)-c1ccc(Nc2ccc(C)cc2C(O)=O)cn1
CCOc1cccc(c1)-c1ccc(Nc2ncccc2C(O)=O)c(F)c1
CCOc1cccc(c1)-c1ncc(Nc2ccc(C)cc2C(O)=O)cc1C
CCOc1nc2nc(C)cc(Nc3ccc(Cl)cc3)n2n1
CCOc1nc2nc(C)cc(Nc3ccc(cc3)C(F)(F)F)n2n1
CCOc1nc2nc(C)cc(Nc3ccc(cc3)S(F)(F)(F)(F)F)n2n1
CCOc1nc2nc(C)cc(Nc3cccc(Cl)c3)n2n1
CCOc1nn(C)c(COc2ccccc2)c1C(O)=O
CCOc1nn(c(C)c1Oc1ccccc1Br)-c1ncc(CC)cn1
CCSc1nnc(C2CCCN(CC(=O)Nc3cc(ccc3Cl)C(F)(F)F)C2)n1CC
CC[C@@H](C)NC(=O)c1ccc(s1)-n1cnc2ccccc12 |r|
CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C |r|
CC[C@H](C)NC(=O)c1ccc(s1)-n1cnc2ccccc12 |r|
CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C1=O |r|
CCc1c(C)nc2ncnn2c1Nc1ccc(OC(F)(F)F)cc1
CCc1c(C)nc2ncnn2c1Nc1ccc(cc1)C(C)C
CCc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
CCc1cc(=O)n2[nH]c(SCc3cc(Cl)ccc3Cl)nc2n1
CCc1cc(=O)n2[nH]c(SCc3ccc(Cl)cc3)nc2n1
CCc1cc(NC(=O)C(C#N)C(=O)C2CC2)ccc1C(F)(F)F
CCc1cc(Nc2ccc(cc2)C(F)(F)F)n2ncnc2n1
CCc1cc(Nc2ccc3ccccc3c2)n2ncnc2n1
CCc1cc(no1)C(=O)NC1CCCc2c1cnn2-c1ccc(F)cc1F
CCc1cc2CCCCCc2cc1NC(=O)c1ccc(cc1)C(C)(C)C
CCc1ccc(Nc2cc(C)nc3ncnn23)cc1
CCc1ccc2nc(C(=O)Nc3c(F)cc(cc3F)-c3cccc(F)c3)c(C)c(O)c2c1
CCc1cccc(Cl)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2CCCCn2c1=O |r|
CCc1cccc(NC(=O)\C=C\c2ccc(Cl)c(Cl)c2)c1
CCc1ccccc1-n1cc(C(C)C)c2cc(c(F)cc2c1=O)-n1nc(CO)n(CC)c1=O
CCc1ccccc1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2CCCCn2c1=O |r|
CCc1cnc(Nc2c(F)cc(cc2F)-c2cccc(OC)c2)c(c1)C(O)=O
CCc1cnc(nc1)-n1nc(OC(C)C)c(Oc2c(F)cccc2F)c1C
CCc1nc2cc(F)ccc2n1-c1ccc(s1)C(=O)NC1CC1
CCc1nc2ccccc2n1-c1ccc(s1)C(=O)NC1CC1
CCc1nc2nc(C)cc(Nc3ccc(cc3)C(F)(F)F)n2n1
CCc1nc2nc(C)cc(Nc3ccc(cc3)S(F)(F)(F)(F)F)n2n1
CCc1nn(-c2cc(OC(C)CC=C)c(cc2F)C(=O)Nc2c(C)cccc2N)c(=O)n1C
CCc1nn(-c2cc(OC(C)CC=C)c(cc2F)C(=O)Nc2ccc(N)cc2C)c(=O)n1C
CCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c(=O)n1C1CC1 |r|
CCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C1CC1 |r|
CCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1CC |r|
CCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1CCO |r|
CCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccc(F)cc2C)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccccc2F)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccccc2F)c(=O)n1C1CC1 |r|
CCc1nn(-c2cc(O[C@@H](C)C3CCCCC3)c(cc2F)C(=O)NC2(CC2)c2ccc(F)cc2)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C3CCCCC3)c(cc2F)C(=O)NC2CCOCC2)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C3CCCCC3)c(cc2F)C(=O)Nc2ccc(SC)cc2)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C3CCCCC3)c(cc2F)C(=O)Nc2ccc(cc2)S(C)(=N)=O)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C3CCCCC3)c(cc2F)C(=O)Nc2cccc(c2)S(C)(=O)=O)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C3CCCCC3)c(cc2F)C(=O)Nc2ccnn2C)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)C3CCCCC3)c(cc2F)C(=O)Nc2nn(C)cc2C)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)CN(C)C)c(cc2F)C(=O)Nc2c(C)cccc2F)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2c(C)cccc2F)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2cc3cn[nH]c3cc2C)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2cccc(c2)C(=O)NC2CC2)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2cccc3nc(C)ccc23)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2ccccc2C(F)F)c(=O)n1C |r|
CCc1nn(-c2cc(O[C@@H](C)c3ccccc3)c(cc2F)C(=O)Nc2cnccc2C)c(=O)n1C |r|
CCc1nn(-c2ccc(C(=O)Nc3c(F)cccc3F)c(O[C@@H](C)C(F)(F)F)c2)c(=O)n1C |r|
CCc1nn(-c2cccc(F)c2)c(=O)c2ccc(cc12)-n1nc(CO)n(CC)c1=O
CCc1nn(-c2ccccc2C)c(=O)c2ccc(cc12)-n1nc(CO)n(CC)c1=O
CCc1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1
CCc1oncc1C(=S)Nc1ccc(cc1)C#N
CCc1oncc1C(=S)Nc1ccc(cc1)C(F)(F)F
CCc1oncc1C(=S)Nc1ccc(cc1)N(C)C
CCc1sc(N\N=C\c2ccccc2C(O)=O)nc1-c1ccccc1Cl
CCn1c(CO)nn(-c2cc(OC(C)C(C)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O |w:12.12|
CCn1c(CO)nn(-c2cc(OC(C)C(F)(F)F)c3c(Nc4c(F)cccc4Cl)nn(C)c3c2)c1=O
CCn1c(CO)nn(-c2cc(OC(C)C(F)(F)F)c3c(Nc4c(F)cccc4Cl)nn(C)c3c2F)c1=O
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)ccnc2OC)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(Cl)ccc(O)c2F)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(Cl)ccc(OC)c2F)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(Cl)cccc2Cl)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cc(O)cc2Cl)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cc(OC(=O)C(C)(C)C)cc2Cl)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)ccc(O)c2Cl)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)ccc(OC)c2Cl)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c3c(Nc4c(C)ccnc4Cl)nn(C)c3c2F)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c3c(Nc4c(F)cccc4Cl)nn(C)c3c2F)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c3c(Nc4c(F)cccc4Cl)noc3c2F)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c3c(Oc4c(F)ccc(N(C)C)c4Cl)nccc3c2)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c3c(Oc4c(F)ccc(OC)c4Cl)nccc3c2)c1=O |r|
CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c3c(Oc4c(F)ccc(OCCOC)c4Cl)nccc3c2)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cc(-c4ccccc4C)c(=O)n3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cc2F)c(nn(-c2c(F)cccc2Cl)c3=O)C(C)=C)c1=O |(7.73,-3.16,;6.24,-3.56,;5.16,-2.46,;5.4,-.94,;6.78,-.25,;6.78,1.29,;4.03,-.24,;2.94,-1.32,;1.61,-.55,;.27,-1.32,;-1.06,-.55,;-1.06,.99,;.27,1.76,;1.61,.99,;2.94,1.76,;-2.39,1.76,;-3.73,.99,;-3.73,-.55,;-5.06,-1.32,;-5.06,-2.86,;-3.73,-3.63,;-6.39,-3.63,;-7.73,-2.86,;-7.73,-1.32,;-6.39,-.55,;-6.39,.99,;-2.39,-1.32,;-2.39,-2.86,;-2.39,3.3,;-3.73,4.07,;-1.06,4.07,;3.63,-2.7,;2.93,-4.07,)|
CCn1c(CO)nn(-c2cc3c(cc2OC)c(nn(-c2c(F)cccc2Cl)c3=O)C(C)=C)c1=O |(7.73,-3.16,;6.24,-3.56,;5.16,-2.46,;5.4,-.94,;6.78,-.25,;6.78,1.29,;4.03,-.24,;2.94,-1.32,;1.61,-.55,;.27,-1.32,;-1.06,-.55,;-1.06,.99,;.27,1.76,;1.61,.99,;2.94,1.76,;2.94,3.3,;-2.39,1.76,;-3.73,.99,;-3.73,-.55,;-5.06,-1.32,;-5.06,-2.86,;-3.73,-3.63,;-6.39,-3.63,;-7.73,-2.86,;-7.73,-1.32,;-6.39,-.55,;-6.39,.99,;-2.39,-1.32,;-2.39,-2.86,;-2.39,3.3,;-3.73,4.07,;-1.06,4.07,;3.63,-2.7,;2.93,-4.07,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)cccc4F)c(=O)c3cc2F)C(C)=C)c1=O |(7.77,2.05,;6.87,.8,;5.33,.96,;4.56,2.29,;5.19,3.7,;4.29,4.95,;3.06,1.97,;2.9,.44,;1.56,-.33,;.23,.44,;-1.1,-.33,;-2.44,.44,;-3.77,-.33,;-3.77,-1.87,;-5.1,-2.64,;-5.1,-4.18,;-3.77,-4.95,;-6.44,-4.95,;-7.77,-4.18,;-7.77,-2.64,;-6.44,-1.87,;-6.44,-.33,;-2.44,-2.64,;-2.44,-4.18,;-1.1,-1.87,;.23,-2.64,;1.56,-1.87,;2.9,-2.64,;-2.44,1.98,;-1.1,2.75,;-3.77,2.75,;4.3,-.18,;4.62,-1.69,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)cccc4F)c(=O)c3cc2F)C(C)C)c1=O |(7.77,2.05,;6.87,.8,;5.33,.96,;4.56,2.29,;5.19,3.7,;4.29,4.95,;3.06,1.97,;2.9,.44,;1.56,-.33,;.23,.44,;-1.1,-.33,;-2.44,.44,;-3.77,-.33,;-3.77,-1.87,;-5.1,-2.64,;-5.1,-4.18,;-3.77,-4.95,;-6.44,-4.95,;-7.77,-4.18,;-7.77,-2.64,;-6.44,-1.87,;-6.44,-.33,;-2.44,-2.64,;-2.44,-4.18,;-1.1,-1.87,;.23,-2.64,;1.56,-1.87,;2.9,-2.64,;-2.44,1.98,;-3.77,2.75,;-1.1,2.75,;4.3,-.18,;4.62,-1.69,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)ccnc4Cl)c(=O)c3cc2F)C(C)C)c1=O |(7.52,-.61,;7.12,.88,;5.59,1.04,;4.82,2.37,;5.44,3.78,;4.36,4.87,;3.31,2.05,;3.15,.52,;1.82,-.25,;.48,.52,;-.85,-.25,;-2.18,.52,;-3.52,-.25,;-3.52,-1.79,;-4.85,-2.56,;-6.18,-1.79,;-6.18,-.25,;-7.52,-2.56,;-7.52,-4.1,;-6.18,-4.87,;-4.85,-4.1,;-3.52,-4.87,;-2.18,-2.56,;-2.18,-4.1,;-.85,-1.79,;.48,-2.56,;1.82,-1.79,;3.15,-2.56,;-2.18,2.06,;-3.52,2.83,;-.85,2.83,;4.56,-.11,;4.88,-1.61,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)ccnc4OC)c(=O)c3cc2F)C(C)=C)c1=O |(7.63,.16,;7.01,1.57,;5.47,1.73,;4.7,3.06,;5.33,4.47,;4.43,5.72,;3.2,2.74,;3.04,1.21,;1.7,.44,;.37,1.21,;-.96,.44,;-2.3,1.21,;-3.63,.44,;-3.63,-1.1,;-4.96,-1.87,;-6.3,-1.1,;-6.3,.44,;-7.63,-1.87,;-7.63,-3.41,;-6.3,-4.18,;-4.96,-3.41,;-3.63,-4.18,;-3.63,-5.72,;-2.3,-1.87,;-2.3,-3.41,;-.96,-1.1,;.37,-1.87,;1.7,-1.1,;3.04,-1.87,;-2.3,2.75,;-.96,3.52,;-3.63,3.52,;4.44,.59,;4.76,-.92,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)ccnc4OC)c(=O)c3cc2F)C(C)C)c1=O |(7.63,.16,;7.01,1.57,;5.47,1.73,;4.7,3.06,;5.33,4.47,;4.43,5.72,;3.2,2.74,;3.04,1.21,;1.7,.44,;.37,1.21,;-.96,.44,;-2.3,1.21,;-3.63,.44,;-3.63,-1.1,;-4.96,-1.87,;-6.3,-1.1,;-6.3,.44,;-7.63,-1.87,;-7.63,-3.41,;-6.3,-4.18,;-4.96,-3.41,;-3.63,-4.18,;-3.63,-5.72,;-2.3,-1.87,;-2.3,-3.41,;-.96,-1.1,;.37,-1.87,;1.7,-1.1,;3.04,-1.87,;-2.3,2.75,;-3.63,3.52,;-.96,3.52,;4.44,.59,;4.76,-.92,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)cnc(OC)c4C)c(=O)c3cc2F)C(C)=C)c1=O |(7.77,3.2,;6.87,1.95,;5.33,2.12,;4.56,3.45,;5.19,4.86,;4.29,6.1,;3.06,3.13,;2.9,1.6,;1.56,.83,;.23,1.6,;-1.1,.83,;-2.44,1.6,;-3.77,.83,;-3.77,-.71,;-5.1,-1.48,;-6.44,-.71,;-6.44,.83,;-7.77,-1.48,;-7.77,-3.02,;-6.44,-3.79,;-6.44,-5.33,;-5.1,-6.1,;-5.1,-3.02,;-3.77,-3.79,;-2.44,-1.48,;-2.44,-3.02,;-1.1,-.71,;.23,-1.48,;1.56,-.71,;2.9,-1.48,;-2.44,3.14,;-1.1,3.91,;-3.77,3.91,;4.3,.97,;4.62,-.53,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)cnc(OC)c4C)c(=O)c3cc2F)C(C)C)c1=O |(7.77,3.2,;6.87,1.95,;5.33,2.12,;4.56,3.45,;5.19,4.86,;4.29,6.1,;3.06,3.13,;2.9,1.6,;1.56,.83,;.23,1.6,;-1.1,.83,;-2.44,1.6,;-3.77,.83,;-3.77,-.71,;-5.1,-1.48,;-6.44,-.71,;-6.44,.83,;-7.77,-1.48,;-7.77,-3.02,;-6.44,-3.79,;-6.44,-5.33,;-5.1,-6.1,;-5.1,-3.02,;-3.77,-3.79,;-2.44,-1.48,;-2.44,-3.02,;-1.1,-.71,;.23,-1.48,;1.56,-.71,;2.9,-1.48,;-2.44,3.14,;-3.77,3.91,;-1.1,3.91,;4.3,.97,;4.62,-.53,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)cnc(OC)c4Cl)c(=O)c3cc2F)C(C)=C)c1=O |(7.77,3.2,;6.87,1.95,;5.33,2.12,;4.56,3.45,;5.19,4.86,;4.29,6.1,;3.06,3.13,;2.9,1.6,;1.56,.83,;.23,1.6,;-1.1,.83,;-2.44,1.6,;-3.77,.83,;-3.77,-.71,;-5.1,-1.48,;-6.44,-.71,;-6.44,.83,;-7.77,-1.48,;-7.77,-3.02,;-6.44,-3.79,;-6.44,-5.33,;-5.1,-6.1,;-5.1,-3.02,;-3.77,-3.79,;-2.44,-1.48,;-2.44,-3.02,;-1.1,-.71,;.23,-1.48,;1.56,-.71,;2.9,-1.48,;-2.44,3.14,;-1.1,3.91,;-3.77,3.91,;4.3,.97,;4.62,-.53,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)cnc(OC)c4Cl)c(=O)c3cc2F)C(C)C)c1=O |(7.63,.55,;7.01,1.95,;5.47,2.12,;4.7,3.45,;5.33,4.86,;4.43,6.1,;3.2,3.13,;3.04,1.6,;1.7,.83,;.37,1.6,;-.96,.83,;-2.3,1.6,;-3.63,.83,;-3.63,-.71,;-4.96,-1.48,;-6.3,-.71,;-6.3,.83,;-7.63,-1.48,;-7.63,-3.02,;-6.3,-3.79,;-6.3,-5.33,;-4.96,-6.1,;-4.96,-3.02,;-3.63,-3.79,;-2.3,-1.48,;-2.3,-3.02,;-.96,-.71,;.37,-1.48,;1.7,-.71,;3.04,-1.48,;-2.3,3.14,;-3.63,3.91,;-.96,3.91,;4.44,.97,;4.76,-.53,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)n[nH]c4Cl)c(=O)c3cc2F)C(C)=C)c1=O |(7.66,2.17,;6.75,.93,;5.22,1.09,;4.45,2.42,;5.08,3.83,;4.17,5.07,;2.94,2.1,;2.78,.57,;1.45,-.2,;.12,.57,;-1.22,-.2,;-2.55,.57,;-3.89,-.2,;-3.89,-1.74,;-5.22,-2.51,;-6.63,-1.88,;-6.95,-.38,;-7.66,-3.03,;-6.89,-4.36,;-5.38,-4.04,;-4.24,-5.07,;-2.55,-2.51,;-2.55,-4.05,;-1.22,-1.74,;.12,-2.51,;1.45,-1.74,;2.78,-2.51,;-2.55,2.11,;-1.22,2.88,;-3.89,2.88,;4.19,-.06,;4.51,-1.56,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(C)n[nH]c4Cl)c(=O)c3cc2F)C(C)C)c1=O |(7.59,2.34,;6.82,1,;5.29,1.17,;4.52,2.5,;5.14,3.91,;4.05,4.99,;3.01,2.18,;2.85,.65,;1.52,-.12,;.18,.65,;-1.15,-.12,;-2.48,.65,;-3.82,-.12,;-3.82,-1.66,;-5.15,-2.43,;-6.57,-1.77,;-6.89,-.26,;-7.59,-2.95,;-6.82,-4.28,;-5.31,-3.96,;-4.17,-4.99,;-2.48,-2.43,;-2.48,-3.97,;-1.15,-1.66,;.18,-2.43,;1.52,-1.66,;2.85,-2.43,;-2.48,2.19,;-1.15,2.96,;-3.82,2.96,;4.26,.02,;4.58,-1.49,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(F)ccc(OC)c4Cl)c(=O)c3cc2F)C(C)=C)c1=O |(18.24,-18.73,;17.61,-17.33,;16.08,-17.17,;15.31,-15.83,;15.94,-14.43,;17.47,-14.26,;13.81,-16.15,;13.65,-17.69,;12.32,-18.45,;10.99,-17.68,;9.65,-18.45,;8.32,-17.68,;6.98,-18.45,;6.99,-19.99,;5.66,-20.76,;4.32,-20,;4.32,-18.46,;2.99,-20.77,;2.99,-22.31,;4.32,-23.08,;4.33,-24.62,;5.66,-25.39,;5.66,-22.31,;7,-23.08,;8.33,-20.76,;8.33,-22.3,;9.65,-19.99,;10.98,-20.77,;12.32,-20,;13.65,-20.77,;8.32,-16.14,;9.65,-15.37,;6.98,-15.37,;15.05,-18.31,;15.37,-19.82,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(F)ccc(OC)c4Cl)c(=O)c3cc2F)C(C)C)c1=O |(7.77,3.2,;6.87,1.95,;5.33,2.12,;4.56,3.45,;5.19,4.86,;4.29,6.1,;3.06,3.13,;2.9,1.6,;1.56,.83,;.23,1.6,;-1.1,.83,;-2.44,1.6,;-3.77,.83,;-3.77,-.71,;-5.1,-1.48,;-6.44,-.71,;-6.44,.83,;-7.77,-1.48,;-7.77,-3.02,;-6.44,-3.79,;-6.44,-5.33,;-5.1,-6.1,;-5.1,-3.02,;-3.77,-3.79,;-2.44,-1.48,;-2.44,-3.02,;-1.1,-.71,;.23,-1.48,;1.56,-.71,;2.9,-1.48,;-2.44,3.14,;-3.77,3.91,;-1.1,3.91,;4.3,.97,;4.62,-.53,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(F)cccc4Cl)c(=O)c3cc2F)C(C)=C)c1=O |(36.41,-17.81,;35.78,-16.4,;34.25,-16.24,;33.48,-14.91,;34.11,-13.5,;35.64,-13.34,;31.98,-15.23,;31.82,-16.76,;30.49,-17.53,;29.15,-16.76,;27.82,-17.52,;26.49,-16.75,;25.15,-17.53,;25.16,-19.06,;23.82,-19.83,;22.49,-19.07,;22.48,-17.53,;21.16,-19.84,;21.16,-21.39,;22.49,-22.16,;23.83,-21.38,;25.16,-22.15,;26.49,-19.83,;26.5,-21.37,;27.82,-19.07,;29.15,-19.84,;30.49,-19.08,;31.82,-19.85,;26.49,-15.21,;27.82,-14.44,;25.15,-14.44,;33.22,-17.39,;33.54,-18.89,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(F)cccc4Cl)c(=O)c3cc2F)C(C)C)c1=O |(16.55,-8.54,;15.93,-7.13,;14.4,-6.97,;13.63,-5.64,;14.25,-4.23,;15.78,-4.07,;12.12,-5.96,;11.96,-7.49,;10.63,-8.25,;9.3,-7.49,;7.97,-8.25,;6.63,-7.48,;5.29,-8.25,;5.3,-9.79,;3.97,-10.56,;3.97,-12.11,;5.31,-12.88,;2.64,-12.88,;1.3,-12.11,;1.3,-10.57,;2.63,-9.8,;2.63,-8.26,;6.64,-10.56,;6.64,-12.1,;7.96,-9.8,;9.29,-10.57,;10.63,-9.8,;11.96,-10.58,;6.63,-5.94,;7.96,-5.17,;5.3,-5.17,;13.37,-8.11,;13.69,-9.62,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4c(F)cccc4Cl)c(=O)c3cc2F)C2(C)CC2)c1=O |(7.77,2.05,;6.87,.8,;5.33,.96,;4.56,2.29,;5.19,3.7,;4.29,4.95,;3.06,1.97,;2.9,.44,;1.56,-.33,;.23,.44,;-1.1,-.33,;-2.44,.44,;-3.77,-.33,;-3.77,-1.87,;-5.1,-2.64,;-6.44,-1.87,;-6.44,-.33,;-7.77,-2.64,;-7.77,-4.18,;-6.44,-4.95,;-5.1,-4.18,;-3.77,-4.95,;-2.44,-2.64,;-2.44,-4.18,;-1.1,-1.87,;.23,-2.64,;1.56,-1.87,;2.9,-2.64,;-2.44,1.98,;-1.1,2.75,;-3.77,2.75,;-2.44,3.52,;4.3,-.18,;4.62,-1.69,)|
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(C)ccc4C)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(C)ccc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(C)ccc4Cl)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(C)ccc4F)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(C)ccc4F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(C)cnc4Cl)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(C)cnc4Cl)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(C)ncc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(C)ncc4Cl)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(F)ccc4C)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(F)ccc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(F)ccc4F)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(F)ccc4F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(O)ncc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(OC)ccc4Cl)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(OC)ccc4F)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(OC)ccc4F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(OC)ncc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(OC)ncc4F)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cc(OC)ncc4F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccc(F)cc4C)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccc(F)cc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cccc(F)c4C)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cccc(F)c4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cccc(OC)c4Cl)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cccc(OCCO)c4Cl)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4C(F)(F)F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4C(F)F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4C)c(=O)c3cc2C)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4C)c(=O)c3cc2F)C(=C)C(F)(F)F)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4C)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4C)c(=O)c3cc2F)C(C)C(F)(F)F)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4C)c(=O)c3cc2F)[C@@H](C)C(F)(F)F)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4C)c(=O)c3cc2F)[C@H](C)C(F)(F)F)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4Cl)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4Cl)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4F)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4OC)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccccc4OC)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cccnc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cccnc4OC)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccnc(O)c4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccnc(OC)c4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccnc(OC)c4Cl)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ccncc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cnccc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cncnc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4cnsc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4csnc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4nc(C)ccc4Cl)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4nc(OC)ccc4Cl)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4nc(OC)ccc4F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4nccc(OC)c4Cl)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ncccc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4nccnc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4ncncc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(-c4nnccc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(C(COC)COC)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(C4CCCC4)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(C4CCCCC4)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn(CC4CC4)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(cn([C@@H]4CCCC[C@@H]4C)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn([C@@H]4CCCC[C@H]4C)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn([C@@H]4CCC[C@@H]4C)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn([C@@H]4CCC[C@H]4C)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn([C@H]4CCCC[C@@H]4C)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn([C@H]4CCCC[C@H]4C)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn([C@H]4CCC[C@@H]4C)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn([C@H]4CCC[C@H](C4)OC)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn([C@H]4CCC[C@H]4C)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn([C@H]4CC[C@H](C4)OC)c(=O)c3cc2F)C(C)C)c1=O |r|
CCn1c(CO)nn(-c2cc3c(cn(c(=O)c3cc2F)C23CCC(CC2)C3)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(nn(-c4c(F)cccc4Cl)c(=O)c3cc2F)C(C)=C)c1=O |(7.7,2.21,;6.93,.88,;5.4,1.04,;4.63,2.37,;5.26,3.78,;4.17,4.87,;3.13,2.05,;2.97,.52,;1.63,-.25,;.3,.52,;-1.04,-.25,;-2.37,.52,;-3.7,-.25,;-3.7,-1.79,;-5.04,-2.56,;-5.04,-4.1,;-3.7,-4.87,;-6.37,-4.87,;-7.7,-4.1,;-7.7,-2.56,;-6.37,-1.79,;-6.37,-.25,;-2.37,-2.56,;-2.37,-4.1,;-1.04,-1.79,;.3,-2.56,;1.63,-1.79,;2.97,-2.56,;-2.37,2.06,;-3.7,2.83,;-1.04,2.83,;4.37,-.11,;4.69,-1.61,)|
CCn1c(CO)nn(-c2cc3c(nn(-c4c(F)cccc4Cl)c(=O)c3cc2F)C(C)C)c1=O |(7.77,2.05,;6.87,.8,;5.33,.96,;4.56,2.29,;5.19,3.7,;4.29,4.95,;3.06,1.97,;2.9,.44,;1.56,-.33,;.23,.44,;-1.1,-.33,;-2.44,.44,;-3.77,-.33,;-3.77,-1.87,;-5.1,-2.64,;-5.1,-4.18,;-3.77,-4.95,;-6.44,-4.95,;-7.77,-4.18,;-7.77,-2.64,;-6.44,-1.87,;-6.44,-.33,;-2.44,-2.64,;-2.44,-4.18,;-1.1,-1.87,;.23,-2.64,;1.56,-1.87,;2.9,-2.64,;-2.44,1.98,;-3.77,2.75,;-1.1,2.75,;4.3,-.18,;4.62,-1.69,)|
CCn1c(CO)nn(-c2cc3c(nn(-c4c(F)cccc4Cl)c(=O)c3cc2OC)C(C)=C)c1=O |(7.7,2.21,;6.93,.88,;5.4,1.04,;4.63,2.37,;5.26,3.78,;4.17,4.87,;3.13,2.05,;2.97,.52,;1.63,-.25,;.3,.52,;-1.04,-.25,;-2.37,.52,;-3.7,-.25,;-3.7,-1.79,;-5.04,-2.56,;-5.04,-4.1,;-3.7,-4.87,;-6.37,-4.87,;-7.7,-4.1,;-7.7,-2.56,;-6.37,-1.79,;-6.37,-.25,;-2.37,-2.56,;-2.37,-4.1,;-1.04,-1.79,;.3,-2.56,;1.63,-1.79,;2.97,-2.56,;2.97,-4.1,;-2.37,2.06,;-3.7,2.83,;-1.04,2.83,;4.37,-.11,;4.69,-1.61,)|
CCn1c(CO)nn(-c2cc3c(nn(-c4ccccc4C)c(=O)c3cc2F)C(C)C(F)(F)F)c1=O
CCn1c(CO)nn(-c2cc3c(nn(-c4ccccc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2cc3c(nn(-c4ccccc4C)c(=O)c3cc2F)[C@@H](C)C(F)(F)F)c1=O |r|
CCn1c(CO)nn(-c2cc3c(nn(-c4ccccc4C)c(=O)c3cc2F)[C@H](C)C(F)(F)F)c1=O |r|
CCn1c(CO)nn(-c2ccc(C(=O)Nc3c(F)cccc3Cl)c(OC(C)C(F)F)c2)c1=O |w:25.26|
CCn1c(CO)nn(-c2ccc(C(=O)Nc3c(F)cccc3Cl)c(O[C@@H](C)C(F)(F)F)c2)c1=O |r|
CCn1c(CO)nn(-c2ccc(C(=O)Nc3c(F)cccc3Cl)c(O[C@@H](C)C(F)(F)F)c2F)c1=O |r|
CCn1c(CO)nn(-c2ccc(C(=O)Nc3c(F)cccc3F)c(O[C@@H](C)C(F)(F)F)c2)c1=O |r|
CCn1c(CO)nn(-c2ccc3c(c2)c(I)cn(-c2ccc(cc2F)[N+]([O-])=O)c3=O)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2c(Cl)cccc2Cl)c3=O)C(C)=C)c1=O |(7.67,-.16,;6.9,1.17,;5.36,1.17,;4.46,2.41,;4.86,3.9,;3.77,4.99,;2.99,1.94,;2.99,.4,;1.66,-.37,;1.66,-1.91,;.33,-2.68,;-1.01,-1.91,;-1.01,-.37,;.33,.4,;-2.34,.4,;-3.67,-.37,;-3.67,-1.91,;-5.01,-2.68,;-6.34,-1.91,;-6.34,-.37,;-7.67,-2.68,;-7.67,-4.22,;-6.34,-4.99,;-5.01,-4.22,;-3.67,-4.99,;-2.34,-2.68,;-2.34,-4.22,;-2.34,1.94,;-3.67,2.71,;-1.01,2.71,;4.46,-.08,;4.94,-1.54,)|
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2c(Cl)cccc2Cl)c3=O)C2(C)CC2)c1=O |(7.67,-.16,;6.9,1.17,;5.36,1.17,;4.46,2.41,;4.86,3.9,;3.77,4.99,;2.99,1.94,;2.99,.4,;1.66,-.37,;1.66,-1.91,;.33,-2.68,;-1.01,-1.91,;-1.01,-.37,;.33,.4,;-2.34,.4,;-3.67,-.37,;-3.67,-1.91,;-5.01,-2.68,;-6.34,-1.91,;-6.34,-.37,;-7.67,-2.68,;-7.67,-4.22,;-6.34,-4.99,;-5.01,-4.22,;-3.67,-4.99,;-2.34,-2.68,;-2.34,-4.22,;-2.34,1.94,;-3.67,2.71,;-1.01,2.71,;-2.34,3.48,;4.46,-.08,;4.94,-1.54,)|
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2c(F)cccc2Cl)c3=O)C(=C)C(F)(F)F)c1=O |(7.67,-.16,;6.9,1.17,;5.36,1.17,;4.46,2.41,;4.86,3.9,;3.77,4.99,;2.99,1.94,;2.99,.4,;1.66,-.37,;1.66,-1.91,;.33,-2.68,;-1.01,-1.91,;-1.01,-.37,;.33,.4,;-2.34,.4,;-3.67,-.37,;-3.67,-1.91,;-5.01,-2.68,;-5.01,-4.22,;-3.67,-4.99,;-6.34,-4.99,;-7.67,-4.22,;-7.67,-2.68,;-6.34,-1.91,;-6.34,-.37,;-2.34,-2.68,;-2.34,-4.22,;-2.34,1.94,;-1.01,2.71,;-3.67,2.71,;-3.67,4.25,;-5.01,1.94,;-5.01,3.48,;4.46,-.08,;4.94,-1.54,)|
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2c(F)cccc2Cl)c3=O)C(C)=C)c1=O |(7.67,-.16,;6.9,1.17,;5.36,1.17,;4.46,2.41,;4.86,3.9,;3.77,4.99,;2.99,1.94,;2.99,.4,;1.66,-.37,;1.66,-1.91,;.33,-2.68,;-1.01,-1.91,;-1.01,-.37,;.33,.4,;-2.34,.4,;-3.67,-.37,;-3.67,-1.91,;-5.01,-2.68,;-5.01,-4.22,;-3.67,-4.99,;-6.34,-4.99,;-7.67,-4.22,;-7.67,-2.68,;-6.34,-1.91,;-6.34,-.37,;-2.34,-2.68,;-2.34,-4.22,;-2.34,1.94,;-3.67,2.71,;-1.01,2.71,;4.46,-.08,;4.94,-1.54,)|
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2c(F)cccc2Cl)c3=O)C(C)C)c1=O |(7.63,-.61,;7.01,.8,;5.47,.96,;4.7,2.29,;5.33,3.7,;4.43,4.95,;3.2,1.97,;3.04,.44,;1.7,-.33,;1.7,-1.87,;.37,-2.64,;-.96,-1.87,;-.96,-.33,;.37,.44,;-2.3,.44,;-3.63,-.33,;-3.63,-1.87,;-4.96,-2.64,;-4.96,-4.18,;-3.63,-4.95,;-6.3,-4.95,;-7.63,-4.18,;-7.63,-2.64,;-6.3,-1.87,;-6.3,-.33,;-2.3,-2.64,;-2.3,-4.18,;-2.3,1.98,;-3.63,2.75,;-.96,2.75,;4.44,-.18,;4.76,-1.69,)|
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2c(F)cccc2Cl)c3=O)C2(C)CC2)c1=O |(7.52,-.61,;7.12,.88,;5.59,1.04,;4.82,2.37,;5.44,3.78,;4.36,4.87,;3.31,2.05,;3.15,.52,;1.82,-.25,;1.82,-1.79,;.48,-2.56,;-.85,-1.79,;-.85,-.25,;.48,.52,;-2.18,.52,;-3.52,-.25,;-3.52,-1.79,;-4.85,-2.56,;-4.85,-4.1,;-3.52,-4.87,;-6.18,-4.87,;-7.52,-4.1,;-7.52,-2.56,;-6.18,-1.79,;-6.18,-.25,;-2.18,-2.56,;-2.18,-4.1,;-2.18,2.06,;-3.52,2.83,;-.85,2.83,;-2.18,3.6,;4.56,-.11,;4.88,-1.61,)|
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2c(F)cccc2Cl)c3=O)C2CC2)c1=O |(7.67,-.16,;6.9,1.17,;5.36,1.17,;4.46,2.41,;4.86,3.9,;3.77,4.99,;2.99,1.94,;2.99,.4,;1.66,-.37,;1.66,-1.91,;.33,-2.68,;-1.01,-1.91,;-1.01,-.37,;.33,.4,;-2.34,.4,;-3.67,-.37,;-3.67,-1.91,;-5.01,-2.68,;-5.01,-4.22,;-3.67,-4.99,;-6.34,-4.99,;-7.67,-4.22,;-7.67,-2.68,;-6.34,-1.91,;-6.34,-.37,;-2.34,-2.68,;-2.34,-4.22,;-2.34,1.94,;-1.57,3.27,;-3.11,3.27,;4.46,-.08,;4.94,-1.54,)|
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2cccc(F)c2)c3=O)-c2ccccc2)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2cccc(F)c2)c3=O)C(C)(C)O)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2cccc(F)c2)c3=O)C(C)=C)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2cccc(F)c2)c3=O)C(C)C)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2ccccc2C#N)c3=O)C(C)=C)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2ccccc2C(F)(F)F)c3=O)C(C)=C)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2ccccc2C)c3=O)C(C)=C)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2ccccc2C)c3=O)N(C)C)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(cn(-c2ccccc2Cl)c3=O)C(C)=C)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(nn(-c2c(F)cccc2Cl)c3=O)C(C)C)c1=O |(7.52,-.61,;7.12,.88,;5.59,1.04,;4.82,2.37,;5.44,3.78,;4.36,4.87,;3.31,2.05,;3.15,.52,;1.82,-.25,;1.82,-1.79,;.48,-2.56,;-.85,-1.79,;-.85,-.25,;.48,.52,;-2.18,.52,;-3.52,-.25,;-3.52,-1.79,;-4.85,-2.56,;-6.18,-1.79,;-6.18,-.25,;-7.52,-2.56,;-7.52,-4.1,;-6.18,-4.87,;-4.85,-4.1,;-3.52,-4.87,;-2.18,-2.56,;-2.18,-4.1,;-2.18,2.06,;-3.52,2.83,;-.85,2.83,;4.56,-.11,;4.88,-1.61,)|
CCn1c(CO)nn(-c2ccc3c(c2)c(nn(-c2cccc(F)c2)c3=O)C(C)C)c1=O
CCn1c(CO)nn(-c2ccc3c(c2)c(nn(-c2ccccc2Cl)c3=O)C(C)C)c1=O
CCn1c(CO)nn(-c2ccc3c(ccn(-c4c(F)cccc4Cl)c3=O)c2)c1=O |(7.67,-.16,;6.9,1.17,;5.36,1.17,;4.46,2.41,;4.86,3.9,;3.77,4.99,;2.99,1.94,;2.99,.4,;1.66,-.37,;1.66,-1.91,;.33,-2.68,;-1.01,-1.91,;-1.01,-.37,;-2.34,.4,;-3.67,-.37,;-3.67,-1.91,;-5.01,-2.68,;-5.01,-4.22,;-3.67,-4.99,;-6.34,-4.99,;-7.67,-4.22,;-7.67,-2.68,;-6.34,-1.91,;-6.34,-.37,;-2.34,-2.68,;-2.34,-4.22,;.33,.4,;4.46,-.08,;4.94,-1.54,)|
CCn1c(CO)nn(-c2nc(NC(C)C)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O
CCn1c(CO)nn(-c2nc(OC(C)C(F)(F)F)c3c(Oc4c(F)cccc4Cl)nccc3c2F)c1=O
CCn1c(CO)nn(-c2nc(OC(C)C)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O
CCn1c(CO)nn(-c2nc(OC3CC(F)(F)C3(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O
CCn1c(CO)nn(-c2nc(OC3CCOC3)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cc(OC)nc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)ccnc2C(F)F)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)ccnc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)ccnc2F)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cnc(OC)c2C)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cnc(OC)c2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)nccc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(Cl)ccnc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(Cl)ccnc2OC)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cnc(OC)c2C#N)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cnc(OC)c2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cncc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2cc(C)cnc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2cc(OC)ncc2C)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccc(C)nc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccccc2F)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2cccnc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccnc(OC)c2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccncc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2cnccc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ncccc2Cl)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c3c(Nc4c(F)cccc4Cl)nncc3c2F)c1=O |r|
CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c3c(Oc4c(F)cccc4Cl)nncc3c2F)c1=O |r|
CCn1c(CO)nn(-c2nc(SC(C)C)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O
CCn1c(CO)nn(-c2nc3c(C)nn(-c4ccccc4C)c(=O)c3cc2F)c1=O
CCn1c(CO)nn(-c2nc3c(cn(-c4c(F)cccc4Cl)c(=O)c3cc2F)C(C)=C)c1=O |(7.77,2.05,;6.87,.8,;5.33,.96,;4.56,2.29,;5.19,3.7,;4.29,4.95,;3.06,1.97,;2.9,.44,;1.56,-.33,;.23,.44,;-1.1,-.33,;-2.44,.44,;-3.77,-.33,;-3.77,-1.87,;-5.1,-2.64,;-6.44,-1.87,;-6.44,-.33,;-7.77,-2.64,;-7.77,-4.18,;-6.44,-4.95,;-5.1,-4.18,;-3.77,-4.95,;-2.44,-2.64,;-2.44,-4.18,;-1.1,-1.87,;.23,-2.64,;1.56,-1.87,;2.9,-2.64,;-2.44,1.98,;-1.1,2.75,;-3.77,2.75,;4.3,-.18,;4.62,-1.69,)|
CCn1c(CO)nn(-c2nc3c(cn(-c4c(F)cccc4Cl)c(=O)c3cc2F)C(C)C)c1=O |(7.77,2.05,;6.87,.8,;5.33,.96,;4.56,2.29,;5.19,3.7,;4.29,4.95,;3.06,1.97,;2.9,.44,;1.56,-.33,;.23,.44,;-1.1,-.33,;-2.44,.44,;-3.77,-.33,;-3.77,-1.87,;-5.1,-2.64,;-6.44,-1.87,;-6.44,-.33,;-7.77,-2.64,;-7.77,-4.18,;-6.44,-4.95,;-5.1,-4.18,;-3.77,-4.95,;-2.44,-2.64,;-2.44,-4.18,;-1.1,-1.87,;.23,-2.64,;1.56,-1.87,;2.9,-2.64,;-2.44,1.98,;-3.77,2.75,;-1.1,2.75,;4.3,-.18,;4.62,-1.69,)|
CCn1c(CO)nn(-c2nc3c(cn(-c4cc(C)ccc4F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2nc3c(cn(-c4ccccc4C(F)F)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2nc3c(cn(-c4ccccc4C)c(=O)c3cc2F)C(C)=C)c1=O
CCn1c(CO)nn(-c2nc3c(cn(-c4ccccc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2nc3c(cn(-c4ccccc4C)c(=O)c3cc2F)[C@@H](C)C(F)(F)F)c1=O |r|
CCn1c(CO)nn(-c2nc3c(cn(-c4ccccc4C)c(=O)c3cc2F)[C@H](C)C(F)(F)F)c1=O |r|
CCn1c(CO)nn(-c2nc3c(cn(-c4ccccc4OC)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2nc3c(cn(-c4scnc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(CO)nn(-c2nc3c(nn(-c4ccccc4C)c(=O)c3cc2F)C(C)C)c1=O
CCn1c(Cl)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O |r|
CCn1c(OC(C)C)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O |r|
CCn1c(SC)nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O |r|
CCn1c(nn(-c2cc(OC(C)C(C)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O)C(O)=O |w:10.10|
CCn1c(nn(-c2cc(OC)c(cc2F)C(=O)Nc2cccc(c2)C(F)(F)F)c1=O)-c1c(Cl)cccc1Cl |(7.51,-.11,;6.94,-1.54,;5.41,-1.71,;4.64,-3.04,;3.14,-2.73,;2.97,-1.2,;1.63,-.44,;1.63,1.1,;.3,1.87,;.3,3.41,;1.63,4.18,;-1.04,1.1,;-1.04,-.44,;.3,-1.21,;.3,-2.75,;-2.37,1.87,;-2.38,3.41,;-3.7,1.1,;-5.04,1.86,;-6.37,1.09,;-7.71,1.86,;-7.71,3.4,;-6.37,4.17,;-5.04,3.4,;-6.37,5.71,;-7.71,6.48,;-5.04,6.48,;-6.37,7.25,;4.37,-.57,;4.68,.94,;5.28,-4.45,;4.38,-5.7,;2.84,-5.54,;5.01,-7.1,;6.54,-7.25,;7.44,-6,;6.81,-4.6,;7.71,-3.35,)|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c1=O)C(O)=O |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c1=O)C1CC1 |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)ccnc2OC)c1=O)C(O)C(F)(F)F |r,w:34.37|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(Cl)cccc2Cl)c1=O)C(O)=O |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O)C(N)=O |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c1=O)C(O)=O |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O)C(=O)N(C)C |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O)C(=O)NC1CC1 |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O)C(=O)OC |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O)C(N)=O |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O)C(O)=O |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O)C1CC1 |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c1=O)S(C)(=N)=O |r|
CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccccc2F)c1=O)C1CC1 |r|
CCn1c(nn(-c2ccc(C(=O)Nc3c(F)cccc3Cl)c(OC(C)C(F)F)c2)c1=O)C(O)=O |w:23.24|
CCn1c(nn(-c2ccc(C(=O)Nc3c(F)cccc3Cl)c(O[C@@H](C)C(F)(F)F)c2)c1=O)C(O)=O |r|
CCn1c(nn(-c2ccc(C(=O)Nc3c(F)cccc3Cl)c(O[C@@H](C)C(F)(F)F)c2F)c1=O)C(O)=O |r|
CCn1c(nn(-c2ccc(C(=O)Nc3c(F)cccc3F)c(O[C@@H](C)C(F)(F)F)c2)c1=O)C(O)=O |r|
CCn1c(nn(-c2ccc(C(=O)Nc3cccc(c3)C(F)(F)F)c(OC)c2)c1=O)-c1c(Cl)cccc1Cl |(-1.19,-10.7,;-.04,-9.67,;1.42,-10.15,;2.67,-9.24,;3.91,-10.15,;3.44,-11.61,;4.34,-12.86,;3.72,-14.26,;4.62,-15.51,;6.15,-15.35,;7.06,-16.59,;6.43,-18,;8.59,-16.43,;9.49,-17.68,;8.87,-19.09,;9.77,-20.33,;11.31,-20.17,;11.93,-18.76,;11.03,-17.52,;13.46,-18.6,;14.99,-18.44,;13.62,-20.13,;13.3,-17.07,;6.78,-13.94,;8.31,-13.78,;9.22,-15.03,;5.87,-12.69,;1.9,-11.61,;.99,-12.86,;2.67,-7.7,;4,-6.93,;5.33,-7.7,;4,-5.39,;2.67,-4.62,;1.33,-5.39,;1.33,-6.93,;,-7.7,)|
CCn1nc(nc1C(C)(C)O)-c1cc2c(cn(-c3ccccc3C)c(=O)c2cc1F)C(C)C
CCn1nc(nc1C(C)=O)-c1cc2c(cn(-c3ccccc3C)c(=O)c2cc1F)C(C)C
CCn1nc(nc1C(C)O)-c1cc2c(cn(-c3ccccc3C)c(=O)c2cc1F)C(C)C
CN(C(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1)c1ccc(Cl)cc1
CN(C(=O)c1ccc(cc1)-c1ccccc1)c1ccccc1C(O)=O
CN(C(=O)c1ccc2cc(Br)ccc2c1)c1ccccc1C(O)=O
CN(C(=O)c1ccc2ccccc2c1)c1ccccc1C(O)=O
CN(C)C(=O)c1ccc(s1)-n1cnc2ccccc12
CN(C)C(=O)c1cccc(c1)-c1ncc(Nc2ccc(C)cc2C(O)=O)cc1C
CN(C)C(=O)c1ccccc1\C=N\N(C)c1nc(cs1)-c1ccccc1Cl
CN(C)C(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
CN(C)Cc1cccc(c1)-c1c(F)c(F)c(-c2cc(C(O)=O)c3n(C)nnc3c2)c(F)c1F
CN(C)c1ccc(NC(=S)c2cnoc2C(C)(C)C)cc1
CN(C)c1ccc(NC(=S)c2cnoc2C)cc1
CN(C)c1ccc(NC(=S)c2cnoc2C2CC2)cc1
CN(C)c1ccc(NC(=S)c2cnoc2C2CCCCC2)cc1
CN(C)c1ccc(Nc2cc(C)nc3ncnn23)cc1
CN(C)c1ccc(cc1)-c1cc(F)c(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1 |t:18|
CN(C)c1ccc(cc1)-c1ccc(NC(=O)C2=C(CCC2)C(O)=O)cc1Cl |t:17|
CN(C)c1cccc(c1)-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O
CN(Cc1c(C(O)=O)c(O)nn1C)c1ccccc1
CN(Cc1cccnc1)c1ccc(NC(=O)C2CC2)c(c1)C(O)=O
CN(O)C(=O)c1c(C)c(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccccc1F
CN(\N=C\c1cc(F)c(F)cc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CN(\N=C\c1cc(N)c(F)cc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CN(\N=C\c1cc(O)c(F)cc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CN(\N=C\c1ccc(C)cc1C(O)=O)c1nc(c(C)s1)-c1ccccc1
CN(\N=C\c1ccc(C)cc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CN(\N=C\c1ccc(F)cc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CN(\N=C\c1ccc(cc1C(O)=O)C(F)(F)F)c1nc(cs1)-c1ccccc1Cl
CN(\N=C\c1ccccc1C(=O)OC1CCCCC1)c1nc(cs1)-c1ccccc1Cl
CN(\N=C\c1ccccc1C(=O)OCCc1ccccc1)c1nc(cs1)-c1ccccc1Cl
CN(\N=C\c1ccccc1C(=O)OCOC(=O)C(C)(C)C)c1nc(cs1)-c1ccccc1Cl
CN(\N=C\c1ccccc1C(O)=O)c1nc(c(C)s1)-c1ccccc1
CN(\N=C\c1ccccc1C(O)=O)c1nc(c(C)s1)-c1ccccc1Cl
CN(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1cc(Cl)ccc1Cl
CN(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1cccc(Cl)c1
CN(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1ccccc1
CN(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
CN(c1[nH]nc(C)c1C#N)c1ccc(cc1)C(F)(F)F
CN(c1ccc2ccccc2c1)c1cc(C)nc2ncnn12
CN(c1cccc(c1)-c1ccccc1)c1nc2ccc(F)cc2c(C([O-])=O)c1C
CN1CCCC1C(=O)C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
CN1CCN(Cc2cccc(c2)-c2c(F)c(F)c(c(F)c2F)-c2cc(C(O)=O)c3n(C)nnc3c2)CC1
CN1CCN(Cc2ccccc2-c2ccc(cc2)-c2cc(C(O)=O)c3nn(C)nc3c2)CC1
CN1N=NC2C=C(C=C(C12)C(O)=O)c1ccc(cc1)-c1ccccc1CN1CCN(C)CC1 |c:2,5,7|
CNC(=O)c1ccc(s1)-n1cnc2ccccc12
CNC(=O)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
CNC1=C(Cl)C(=O)c2ccccc2C1=O |c:2|
CNCc1cccc(c1)-c1c(F)c(F)c(c(F)c1F)-c1cc(C(O)=O)c2n(C)nnc2c1
CNc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
COC(=O)Cc1cccc(c1)-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O
COC(=O)NC(=O)c1c(C)c(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccccc1F
COC(=O)c1c(C)c(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccc(OCCOCCOCCOC(=O)N[C@H](C(=O)N2C[C@H](O)C[C@H]2C(=O)NCc2ccc(cc2)-c2scnc2C)C(C)(C)C)cc1 |r|
COC(=O)c1c(C)c(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccccc1
COC(=O)c1c(O)csc1Nc1ccc(C)c(C)c1
COC(=O)c1c(O)csc1Nc1ccc2ccccc2c1
COC(=O)c1c(noc1-c1cnn(c1C(F)(F)F)-c1cccc(Cl)c1)-c1c(Cl)cccc1Cl |(52.01,-29.91,;52.92,-28.66,;52.29,-27.25,;50.76,-27.09,;53.2,-26.01,;52.73,-24.55,;53.97,-23.64,;55.22,-24.55,;54.74,-26.01,;55.64,-27.26,;55.17,-28.72,;56.41,-29.63,;57.66,-28.72,;57.19,-27.26,;58.09,-26.01,;59.62,-26.17,;57.47,-24.6,;58.85,-24.67,;59.13,-29.2,;59.44,-30.71,;60.9,-31.18,;62.05,-30.16,;61.73,-28.64,;62.87,-27.61,;60.26,-28.17,;51.26,-24.07,;50.95,-22.57,;52.1,-21.54,;49.49,-22.09,;48.34,-23.12,;48.67,-24.64,;50.13,-25.1,;49.52,-26.65,)|
COC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1ccccc1
COC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1cccnc1
COC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1cnccc1C(F)(F)F
COC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)C1CCCCC1
COC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)N1CCCCC1
COC(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
COC(=O)c1ccc(Nc2nc(c(C)s2)-c2ccc(Cl)cc2)cc1
COC(=O)c1ccc(nc1)C(=O)NC1CCCc2c1cnn2-c1cc(F)cc(F)c1
COC(=O)c1ccc(nc1)C(=O)NC1CCCc2c1cnn2-c1ccccc1F
COC(=O)c1ccc2nc(c(C)c(C(O)=O)c2c1)-c1ccc(cc1)-c1ccccc1
COC(=O)c1cccc(C)c1NC(=O)c1cc(F)c(cc1O[C@H](C)C1CCCCC1)-n1nc2CCCCn2c1=O |r|
COC(=O)c1cccc(c1)-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
COC(C)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
COC(c1c[nH]c(C(=O)NC(C)c2cc(C)on2)c1C)c1ccc(nc1)C(F)(F)F
COC1CCCc2sc(Nc3cccc(CN4CCN(CC4)C(=O)C4CCCC4)c3C)nc12
COCc1c(Cc2ccc(nc2)C(F)(F)F)c[nH]c1C(=O)NC1CC1
COCc1cccc(c1)-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O
CONC(=O)c1c(C)c(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccccc1F
CONC(=O)c1cc(C)cc2nc([nH]c12)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F
COc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
COc1cc(C)c(NC(=O)c2cc(Cl)c(cc2O[C@@H](C)C(F)(F)F)-n2nc3CCCCn3c2=O)cn1 |r|
COc1cc(C)c(NC(=O)c2cc(F)c(cc2O[C@@H](C)C(F)(F)F)-n2nc3CCCCn3c2=O)cn1 |r|
COc1cc(C)c(NC(=O)c2cc(F)c(cc2O[C@@H](C)C(F)(F)F)-n2nc3COCCn3c2=O)cn1 |r|
COc1cc(C)c(NC(=O)c2cc(F)c(cc2O[C@@H](C)C2CCCCC2)-n2nc3CCCCn3c2=O)cn1 |r|
COc1cc(C)c(NC(=O)c2cc(F)c(cc2O[C@@H](C)CN(C)C)-n2nc3CCCCn3c2=O)cn1 |r|
COc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1Br
COc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1Cl
COc1cc(c(C)cn1)-n1cc(C(C)C)c2cc(-c3cn(C)c(n3)C(C)(C)O)c(F)cc2c1=O
COc1cc(c(C)cn1)-n1cc(C(C)C)c2cc(-c3nc(n(C)n3)C(C)(C)O)c(F)cc2c1=O
COc1cc(cc(OC)c1-c1ccccc1)-c1nc2c(cccc2[nH]1)C(O)=O
COc1cc(cc(OC)c1OC)-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
COc1cc(ccc1-c1ccccc1)-n1nnc2c1C(=O)c1ccccc1C2=O
COc1cc(ccc1-c1nc2c(cc(C)cc2[nH]1)C(O)=O)-c1ccccc1
COc1cc(ccc1Cc1c[nH]c(C(=O)NC2CC2)c1C)C(F)(F)F
COc1cc(ccc1NC(=O)C1=C(CCC1)C(O)=O)-c1ccccc1Cl |t:12|
COc1cc(ccc1NC(=O)C1CC1)-c1ccc(-c2nc3c(cc(F)cc3[nH]2)C(N)=O)c(F)c1
COc1cc(ccc1OCC(=O)NC12CC3CC(CC(C3)C1)C2)-c1cc(C(O)=O)c2ccccc2n1 |TLB:12:13:16:20.18.19,THB:18:17:14:20.19.21,18:19:16.17.22:14,21:19:16:22.13.14,21:13:16:20.18.19|
COc1cc(ccc1OCC(=O)NC1CCCCC1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)NCc1ccccc1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)NCc1cccnc1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)NCc1ccco1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)NCc1cccs1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1ccc(C)cc1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1ccc(Cl)cc1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1ccc(F)cc1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1ccc(cc1)C(F)(F)F)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1cccc(C)c1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1cccc(Cl)c1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1cccc(F)c1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1cccc(c1)C(F)(F)F)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1ccccc1)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1ccccc1C(F)(F)F)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1ccccc1C)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1ccccc1Cl)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(=O)Nc1ccccc1F)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(ccc1OCC(C)C)-c1cc(C(O)=O)c2ccccc2n1
COc1cc(nc2ccccc12)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r|
COc1cc2CC(Cc2cc1OC)Nc1cc(C)nc2ncnn12
COc1cc2CCCCCc2cc1C(=O)Nc1cc([nH]n1)C(C)(C)C
COc1cc2CCCCCc2cc1C(=O)Nc1ccc(cc1)C(C)(C)C
COc1cc2CCCCCc2cc1C(=O)Nc1ccc(cc1)C(C)(C)C#N
COc1cc2CCCCCc2cc1C(=O)Nc1ccc(cc1)C(C)(C)O
COc1cc2CCCCCc2cc1C(=O)Nc1ccc(cn1)C(C)(C)C
COc1cc2CCCCCc2cc1NC(=O)c1ccc(cc1)C(C)(C)C
COc1cc2CCCCCc2nc1NC(=O)c1ccc(cn1)C(C)(C)C
COc1cc2CCCCc2cc1NC(=O)c1ccc(cc1)C(C)(C)C
COc1cc2N(CCc2c(c1)-c1ccccc1)c1nc2ccc(F)cc2c(C([O-])=O)c1C
COc1cc2OC[C@H]3Oc4c5C[C@@H](Oc5ccc4C(=O)[C@H]3c2cc1OC)C(C)=C |r|
COc1ccc(CSc2nc3nc(C)cc(=O)n3[nH]2)cc1
COc1ccc(Cc2c[nH]c(C(=O)NC3CC3)c2C)c2cnccc12
COc1ccc(F)c(c1)-c1cc(C)c(Nc2ccc(C)cc2C(O)=O)cn1
COc1ccc(F)cc1-c1ncc(Nc2ccc(C)cc2C(O)=O)cc1C
COc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
COc1ccc(NC(=O)c2cc(F)c(cc2O[C@@H](C)C(F)(F)F)-n2nc3CCCCn3c2=O)c(C)n1 |r|
COc1ccc(NC(=O)c2cc(F)c(cc2O[C@@H](C)C2CCCCC2)-n2nc3CCCCn3c2=O)c(C)n1 |r|
COc1ccc(NC(=O)c2cc(F)c(cc2O[C@@H](C)C2CCCCC2)-n2nc3CCCCn3c2=O)nn1 |r|
COc1ccc(NC2=C(O)C(=O)c3ccccc3C2=O)cc1 |c:7|
COc1ccc(Nc2cc(C)nc3ncnn23)cc1
COc1ccc(Nc2ccccc2C(O)=O)cc1
COc1ccc(c(OC)c1)-c1cc(F)c(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1 |t:19|
COc1ccc(cc1)-c1cc(C(=O)OCc2ccccc2)c2cc(C)ccc2n1
COc1ccc(cc1)-c1cc(C(=O)OCc2ccccc2)c2cc(Cl)c(Cl)cc2n1
COc1ccc(cc1)-c1cc(COCc2ccccc2)c2cc(Cl)c(Cl)cc2n1
COc1ccc(cc1)-c1ccc(NC(=O)C2=C(CCC2)C(O)=O)c(Cl)c1 |t:16|
COc1ccc(cc1)-c1ccc(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1 |t:16|
COc1ccc(cc1)-c1ccc-2c(CCc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
COc1ccc(cc1)-n1nc(cc1C(=O)NCc1ccccc1)C(=O)NC(c1ccccc1)c1ccccc1
COc1ccc(cc1)-n1nc(cc1C(=O)NCc1ccccc1)C(=O)Nc1ccc(cc1)C(=O)N1CCCC1
COc1ccc(cc1)-n1nc(cc1C(=O)Nc1ccc(cc1)C(=O)N1CCCC1)C(=O)NCC(C)C
COc1ccc(cc1)-n1nc(cc1C(=O)Nc1ccc(cc1)C(=O)N1CCCC1)C(=O)NCC1CCCO1
COc1ccc(cc1)-n1nc(cc1C(=O)Nc1ccc(cc1)C(=O)N1CCCC1)C(=O)NCc1ccccc1
COc1ccc(cc1)-n1nc(cc1C(=O)Nc1ccccc1)C(=O)NCc1cccnc1
COc1ccc(cc1)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
COc1ccc(cc1NC(=O)c1cc(F)c(cc1O[C@@H](C)C1CCCCC1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
COc1ccc(cc1NC(=O)c1cccc2nc([nH]c12)-c1cc(Br)nn1-c1ncccc1Cl)C(F)(F)F
COc1ccc2C(=O)c3c(nnn3-c3cc(F)c(c(F)c3)-c3ccccc3F)C(=O)c2c1 |(54.47,-19.16,;54.47,-20.7,;55.8,-21.47,;55.8,-23.01,;57.13,-23.78,;58.46,-23.01,;59.8,-23.79,;59.79,-25.33,;61.14,-23.01,;61.15,-21.46,;62.62,-20.99,;63.53,-22.25,;62.61,-23.5,;63.08,-24.96,;62.04,-26.1,;62.51,-27.57,;61.48,-28.7,;64.02,-27.89,;65.05,-26.74,;66.56,-27.07,;64.58,-25.29,;64.49,-29.35,;63.45,-30.49,;63.92,-31.96,;65.43,-32.28,;66.46,-31.13,;65.99,-29.67,;67.02,-28.53,;59.8,-20.68,;59.8,-19.14,;58.46,-21.46,;57.13,-20.7,)|
COc1ccc2C(=O)c3nnn(c3C(=O)c2c1)-c1cc(F)c(c(F)c1)-c1ccccc1F |(3.84,-42.26,;5.17,-43.03,;6.51,-42.26,;6.51,-40.72,;7.84,-39.95,;9.17,-40.71,;10.51,-39.93,;10.51,-38.4,;11.85,-40.72,;13.33,-40.24,;14.24,-41.5,;13.32,-42.75,;11.85,-42.27,;10.5,-43.04,;10.5,-44.58,;9.17,-42.27,;7.84,-43.03,;13.79,-44.22,;12.75,-45.35,;13.22,-46.82,;12.19,-47.96,;14.73,-47.15,;15.76,-46,;17.27,-46.32,;15.29,-44.54,;15.2,-48.61,;14.16,-49.75,;14.63,-51.21,;16.14,-51.53,;17.17,-50.38,;16.7,-48.93,;17.73,-47.78,)|
COc1ccc2CC(CCc2c1)Nc1cc(C)nc2nc(nn12)C(C)(F)F
COc1ccc2CCC(Cc2c1)Nc1cc(C)nc2nc(nn12)C(C)(F)F
COc1ccc2c(C(O)=O)c(O)c(nc2c1)-c1ccc(Cl)cc1
COc1ccc2n(c(C)nc2c1)-c1ccc(s1)C(=O)NC1CC1
COc1ccc2nc(C(=O)Nc3c(F)cc(cc3F)-c3cccc(F)c3)c(C)c(O)c2c1
COc1ccc2nc(C(=O)Nc3ccc(cc3)-c3ccccc3)c(C)c(C(O)=O)c2c1
COc1ccc2nc(C(=O)Nc3ccc(cc3)-c3ccccc3)c(C)c(O)c2c1
COc1ccc2nc(c(O)c(C(O)=O)c2c1)-c1ccc(Cl)cc1
COc1cccc(-c2ccc(cc2)-c2cc(C(O)=O)c3nc(C)[nH]c3c2)c1F
COc1cccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2CCCCn2c1=O |r|
COc1cccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2COCCCn2c1=O |r|
COc1cccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2COCCn2c1=O |r|
COc1cccc(NC(=O)c2cc(F)c(cc2O[C@@H](C)C(F)(F)F)-n2nc3CCCCn3c2=O)c1OC |r|
COc1cccc(Nc2[nH]c(N)nc3cc4ccccc4c23)c1
COc1cccc(c1)-c1c(F)c(F)c(NC(=O)c2c(O)nn3ccccc23)c(F)c1F
COc1cccc(c1)-c1c(F)c(F)c(Nc2ncccc2C(O)=O)c(F)c1F
COc1cccc(c1)-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O
COc1cccc(c1)-c1cc(F)c(NC(=O)C(\C#N)=C(\C)O)cc1OC
COc1cccc(c1)-c1cc(F)c(NC(=O)C(\C#N)=C(\C)O)cc1OC(C)C
COc1cccc(c1)-c1cc(F)c(NC(=O)C(\C#N)=C(\C)O)cc1OCC(C)C
COc1cccc(c1)-c1cc(F)c(NC(=O)C(\C#N)=C(\C)O)cc1OCC1CCCCC1
COc1cccc(c1)-c1cc(F)c(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1 |t:17|
COc1cccc(c1)-c1cc(F)c(Nc2ncc(C)cc2C(O)=O)c(F)c1
COc1cccc(c1)-c1cc(F)c(Nc2ncccc2C(O)=O)c(F)c1
COc1cccc(c1)-c1cc(F)c(Nc2ncccc2C(O)=O)cc1C
COc1cccc(c1)-c1cc(F)c(Nc2ncccc2C(O)=O)cc1F
COc1cccc(c1)-c1ccc(-c2nc3c(cccc3[nH]2)C(O)=O)c(F)c1
COc1cccc(c1)-c1ccc(NC(=O)C2=C(C(O)CC2)C(O)=O)c(F)c1 |t:16|
COc1cccc(c1)-c1ccc(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1 |t:16|
COc1cccc(c1)-c1ccc(NC(=O)C2=C(CCC2)C(O)=O)c(OC)c1 |t:16|
COc1cccc(c1)-c1ccc(NC(=O)C2=C(CCC2O)C(O)=O)c(F)c1 |t:16|
COc1cccc(c1)-c1ccc(NC(=O)C2=C(COC2)C(O)=O)c(F)c1 |t:16|
COc1cccc(c1)-c1ccc(NC(=O)C2=C(CSC2)C(O)=O)c(F)c1 |t:16|
COc1cccc(c1)-c1ccc(NC(=O)c2ccsc2C(O)=O)c(F)c1
COc1cccc(c1)-c1ccc(Nc2ncc(cc2C(O)=O)C2CC2)c(F)c1
COc1cccc(c1)-c1ccc(Nc2ncccc2C(O)=O)c(Cl)c1
COc1cccc(c1)-c1ccc(cc1)-c1cc(C(O)=O)c2nc(C)[nH]c2c1
COc1cccc(c1)-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
COc1cccc(c1)-c1ccc-2c(CCc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
COc1cccc(c1)-c1ccc-2c(CCc3c-2nc2ccc(F)cc2c3C([O-])=O)n1
COc1cccc(c1)-c1cccc2N(CCc12)c1nc2ccc(F)cc2c(C([O-])=O)c1C
COc1cccc(c1)-c1cccc2c(cn(C)c12)-c1nc2ccc(F)cc2c(C([O-])=O)c1C
COc1cccc(c1)-c1ncc(Nc2ccc(C)cc2C(O)=O)cc1C
COc1cccc(c1)-c1ncc(Nc2ccc(C)cc2C(O)=O)cc1C(F)(F)F
COc1cccc(c1)-c1ncc(Nc2ccc(cc2C(O)=O)C(F)(F)F)cc1C
COc1cccc(c1)-c1ncc(Nc2ccc(cc2C(O)=O)C2CC2)cc1C(F)(F)F
COc1cccc(c1)C(=O)Nc1nc2ccccc2s1
COc1cccc(c1F)-c1cc(F)c(Nc2ncccc2C(O)=O)c(F)c1
COc1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1
COc1ccccc1-c1c(F)c(F)c(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1F |t:18,(1.02,8.12,;-.07,7.03,;.7,5.69,;2.24,5.69,;3.01,4.36,;2.24,3.03,;.7,3.03,;-.07,4.36,;-1.61,4.36,;-2.38,5.69,;-1.61,7.03,;-3.92,5.69,;-4.69,7.03,;-4.69,4.36,;-6.23,4.36,;-7,3.03,;-6.23,1.69,;-8.54,3.03,;-9.21,4.41,;-10.73,4.21,;-11.01,2.69,;-9.65,1.96,;-8.48,5.77,;-9.29,7.08,;-6.94,5.82,;-3.92,3.03,;-4.69,1.69,;-2.38,3.03,;-1.61,1.69,)|
COc1ccccc1-c1cc(F)c(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1 |t:17|
COc1ccccc1-c1ccc(NC(=O)C(C#N)C(C)=O)c(Cl)c1
COc1ccccc1-c1ccc(NC(=O)C2=C(CCC2)C(O)=O)c(Cl)c1 |t:16|
COc1ccccc1-c1ccc(cc1)-c1cc(C(O)=O)c2ccccc2n1
COc1ccccc1-c1ccc(cc1)-c1cc(C(O)=O)c2nc(C)[nH]c2c1
COc1ccccc1-c1ccc-2c(CCc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
COc1ccccc1-c1cccc2N(CCc12)c1nc2ccc(F)cc2c(C([O-])=O)c1C
COc1ccccc1-c1cccc2c(cn(C)c12)-c1nc2ccc(F)cc2c(C([O-])=O)c1C
COc1ccccc1-n1nnc2c1C(=O)c1ccccc1C2=O
COc1ccccc1NC(=O)Nc1cccc2ccccc12
COc1ccccc1NC(=O)c1cccc2nc([nH]c12)-c1cc(Br)nn1-c1ncccc1Cl
COc1cncc(NC(=O)c2cc(F)c(cc2O[C@@H](C)C2CCCCC2)-n2nc3CCCCn3c2=O)c1C |r|
COc1cncc(NC(=O)c2cc(F)c(cc2O[C@@H](C)C2CCCCC2)-n2nc3CCCCn3c2=O)n1 |r|
COc1cncnc1NC(=O)c1cc(F)c(cc1O[C@@H](C)C1CCCCC1)-n1nc2CCCCn2c1=O |r|
COc1nc2nc(C)cc(Nc3ccc(cc3)S(F)(F)(F)(F)F)n2n1
COc1nc2nc(C)cc(Nc3cccc(Cl)c3)n2n1
COc1ncc(NC(=O)c2cc(F)c(cc2O[C@@H](C)C2CCCCC2)-n2nc3CCCCn3c2=O)cn1 |r|
COc1ncc(Nc2ccc(cc2C(O)=O)C2CC2)cc1-c1ccccc1
COc1nccc(C)c1NC(=O)c1cc(Cl)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2CCCCn2c1=O |r|
COc1nccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc(CO)n(C)c1=O |r|
COc1nccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc([C@H](C)O)n(C)c1=O |r|
COc1nccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc(n(C)c1=O)C(C)(C)O |r|
COc1nccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2CCCCn2c1=O |r|
COc1nccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2COCCCn2c1=O |r|
COc1nccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C(F)(F)F)-n1nc2COCCn2c1=O |r|
COc1nccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C1CCCCC1)-n1nc2CCCCn2c1=O |r|
COc1nccc(C)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)CN(C)C)-n1nc2CCCCn2c1=O |r|
COc1ncccc1-c1ccc(cc1)-c1cc(C(O)=O)c2ccccc2n1
COc1nccnc1NC(=O)c1cc(F)c(cc1O[C@@H](C)C1CCCCC1)-n1nc2CCCCn2c1=O |r|
COc1ncnc(OC)c1NC(=O)c1cc(F)c(cc1O[C@@H](C)C1CCCCC1)-n1nc2CCCCn2c1=O |r|
COc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C1CC1 |r|
CS(=O)(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
CS(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
CSc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
CSc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
CSc1ccc2nc(c(C)c(C(O)=O)c2c1)-c1ccc(cc1)-c1ccccc1
CSc1nc(cs1)C(=O)NC1CCCc2c1cnn2-c1ccc(F)cc1F
CSc1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2F)c(=O)n1C |r|
C[C@@H](CN(C)C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc2CCCCn2c1=O |r|
C[C@@H](CN(C)C)Oc1cc(c(F)cc1C(=O)Nc1cc(F)ccc1C)-n1nc2CCCCn2c1=O |r|
C[C@@H](CN(C)C)Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1C)-n1nc2CCCCn2c1=O |r|
C[C@@H](CN(C)C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C(F)F)-n1nc2CCCCn2c1=O |r|
C[C@@H](CN(C)C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc2CCCCn2c1=O |r|
C[C@@H](CN(C)C)Oc1cc(c(F)cc1C(=O)Nc1cnccc1C)-n1nc2CCCCn2c1=O |r|
C[C@@H](CN(C)C)Oc1cc(c(F)cc1C(=O)Nc1ncc(C)nc1C)-n1nc2CCCCn2c1=O |r|
C[C@@H](CN(C)C)Oc1cc(c(F)cc1C(=O)Nc1nnccc1C)-n1nc2CCCCn2c1=O |r|
C[C@@H](CN1CCCC1)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc2CCCCn2c1=O |r|
C[C@@H](N(C)C(=O)CSc1nnnn1-c1ccc(O)cc1)c1ccc(cc1)-c1ccccc1 |r|
C[C@@H](N)c1nn(-c2cc(OC(C)C3CCCCC3)c(cc2F)C(=O)Nc2ccc(N)cc2C)c(=O)n1C
C[C@@H](NC(=O)c1[nH]c(C)c(Cc2ccc(nc2)C(F)(F)F)c1C#N)c1cn[nH]c1 |r|
C[C@@H](O)[C@@H](C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc2CCCCn2c1=O |r|
C[C@@H](O)c1nn(cc1C)-c1cc(O[C@@H](C)C(F)(F)F)c(cc1F)C(=O)Nc1c(C)n[nH]c1Cl |r|
C[C@@H](O)c1nn(cc1C)-c1cc(O[C@@H](C)C(F)(F)F)c(cc1F)C(=O)Nc1c(F)cccc1Cl |r|
C[C@@H](Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@@H](Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@@H](Oc1cc(c(F)cc1C(=O)Nc1cccc2CNCc12)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CC\C(C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CC\C(C)=C\Cc1c(O)cc(C)c(C=O)c1O |r|
C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)C[C@@H](O)C(\C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)C\C=C(/C)[C@@H](O)Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)\C=C\C(=C)[C@H](O)Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)\C=C\C(\C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)\C=C\C(\C)=C\Cc1c(O)cc(C)c(C=O)c1O |r|
C[C@@H]1CC[C@@H](O)[C@H](C)[C@@]1(C)\C=C\C(\C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C[C@H](CN(C)C)Oc1cc(c(F)cc1C(=O)Nc1c(C)cccc1F)-n1nc2CCCCn2c1=O |r|
C[C@H](CN)Oc1cc(c(F)cc1C(=O)Nc1c(F)cccc1Cl)-n1nc2CCCCn2c1=O |r|
C[C@H](O)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c(=O)n1C |r|
C[C@H](O)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(Cl)cccc2Cl)c(=O)n1C |r|
C[C@H](O)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(F)cccc2Cl)c(=O)n1C |r|
C[C@H](O)c1nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2ccccc2C)c(=O)n1C |r|
C[C@H](O)c1nn(cc1C)-c1cc(O[C@@H](C)C(F)(F)F)c(cc1F)C(=O)Nc1c(C)n[nH]c1Cl |r|
C[C@H](O)c1nn(cc1C)-c1cc(O[C@@H](C)C(F)(F)F)c(cc1F)C(=O)Nc1c(F)cccc1Cl |r|
C[C@H](Oc1c(F)c(ccc1C(=O)Nc1c(F)cccc1Cl)-n1nc(n(C)c1=O)C(C)(C)O)C(F)(F)F |r|
C[C@H](Oc1cc(-c2cn(C)c(n2)C(C)(C)O)c(F)c2n(C)nc(Nc3c(C)ccnc3Cl)c12)C(F)(F)F |r|
C[C@H](Oc1cc(-c2cn(C)c(n2)C(C)(C)O)c(F)cc1C(=O)Nc1c(F)cccc1Cl)C(F)(F)F |r|
C[C@H](Oc1cc(-c2cn(C)c(n2)C(C)(C)O)c(F)cc1C(=O)Nc1ccccc1C)C(F)(F)F |r|
C[C@H](Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(Br)cccc1Br)C(F)(F)F |r|
C[C@H](Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(Cl)cccc1Br)C(F)(F)F |r|
C[C@H](Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(Cl)cccc1Cl)C(F)(F)F |r|
C[C@H](Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1Br)C(F)(F)F |r|
C[C@H](Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1Cl)C(F)(F)F |r|
C[C@H](Oc1cc(NC(=O)C(\C#N)=C(\C)O)c(F)cc1C(=O)Nc1c(F)cccc1F)C(F)(F)F |r|
C[C@H](Oc1cc(c(Cl)cc1C(=O)NC1(CC1)c1ccc(F)cc1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(Cl)cc1C(=O)Nc1c(F)cccc1Cl)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(Cl)cc1C(=O)Nc1c(F)cccc1F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(Cl)cc1C(=O)Nc1ccc(F)cc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(Cl)cc1C(=O)Nc1ccccc1C(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(Cl)cc1C(=O)Nc1ccccc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(Cl)cc1C(=O)Nc1nnccc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1(CC1)c1ccc(F)cc1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CC1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCC(CC1)N(C)C)-n1nc2CCCCn2c1=O)C(F)(F)F |r,wD:1.0,(4.29,1.98,;2.96,2.75,;1.63,1.98,;1.63,.44,;2.96,-.33,;2.96,-1.87,;1.63,-2.64,;1.63,-4.18,;.29,-1.87,;.29,-.33,;-1.04,.44,;-1.04,1.98,;-2.37,-.33,;-3.71,.44,;-5.04,-.33,;-6.37,.44,;-6.37,1.98,;-5.04,2.75,;-3.71,1.98,;-7.71,2.75,;-9.04,1.98,;-7.71,4.29,;4.29,-2.64,;4.46,-4.17,;5.96,-4.49,;6.73,-5.83,;8.27,-5.83,;9.04,-4.49,;8.27,-3.16,;6.73,-3.16,;5.7,-2.02,;6.1,-.53,;2.96,4.29,;2.96,5.83,;1.63,5.06,;4.29,5.06,)|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCC(F)(F)CC1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCC(F)(F)CC1)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCN(C)CC1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCN(C)CC1)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCN(CC1)S(C)(=O)=O)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCN(CC1)S(C)(=O)=O)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCOCC1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCOCC1)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CCS(=O)(=O)CC1)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CN(C1)C(=O)OC(C)(C)C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1CNC1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NC1COC1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)NCC(C)(C)O)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
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C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(F)ccc1C#N)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(F)ccc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(F)ccc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(F)ccc1C)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(F)ccc1Cl)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(F)ccc1Cl)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(F)ccc1Cl)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(ccc1C)C(F)(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(ccc1C)C(F)(F)F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc(ccc1C)C(O)=O)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cc2cn[nH]c2cc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1C#N)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1C#N)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1C#N)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1C)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1Cl)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1Cl)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1Cl)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(F)cc1F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(N)cc1C(F)(F)F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(cc1)C(F)(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(cc1C)C(F)(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(cc1C)C(F)(F)F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(cc1C)C(F)(F)F)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(cc1C)S(N)(=O)=O)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(cc1Cl)S(F)(F)(F)(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(nn1)N1CCOCC1)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc2NC(=O)COc2c1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc2cccnc2c1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc2nc(C)ccc2c1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc2nc(C)sc2c1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc2ncccc2c1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(C(N)=O)c1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(CO)c1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(F)c1C#N)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(F)c1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(F)c1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(F)c1C)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(F)c1Cl)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(F)c1Cl)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(N)c1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(c1)C(=O)N(C)C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(c1)C(F)(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(c1)C(F)(F)F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(c1)C(F)(F)F)-n1nc2CCCCn2c1=O)c1ccccc1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(c1)S(N)(=O)=O)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(c1C)C(F)(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(c1C)C(F)(F)F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(c1CO)C(F)(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc(c1CO)C(F)(F)F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc2cccnc12)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc2cn[nH]c12)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc2nc(C)ccc12)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccc2ncccc12)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1C(F)(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1C(F)(F)F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1C(F)F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1C(F)F)-n1nc2COCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1C(F)F)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc2CCCCn2c1=O)c1ccccc1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc2COCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1Cl)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc(C)n(C2CC2)c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc(C2CC2)n(C)c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc(C2CCC2)n(C)c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc(n(C)c1=O)C(F)(F)F)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc2CCCCn2c1=O)c1ccccc1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc2ccccn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccccc1F)-n1nc2ccccn2c1=O)c1ccccc1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cccnc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccncc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccncc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccnn1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccnn1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cn(C)nc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cn(C)nc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cnc(C)nc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cnccc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cnccc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cnccc1C)-n1nc2COCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cncnc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1cnoc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ncc(C)nc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ncc(N)cc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ncccc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ncccc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1nccnc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1nccnc1N1CCOCC1)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ncnc(C)c1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ncnc2[nH]ccc12)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ncncc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ncncc1F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1nn(C)cc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1nn(C)cc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1nnccc1C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C[C@H](Oc1cc(c(F)cc1C(=O)Nc1oncc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(ccc1C(=O)Nc1c(F)cccc1Cl)-n1nc(n(C)c1=O)C(C)(C)O)C(F)(F)F |r|
C[C@H](Oc1cc(ccc1C(=O)Nc1c(F)cccc1F)-n1nc2CCCCn2c1=O)C(F)(F)F |r|
C[C@H](Oc1cc(ccc1C(=O)Nc1ccc(cc1C)C(=O)OC(C)(C)C)-n1nc2CCCCn2c1=O)C1CCCCC1 |r|
C\C(=C/c1ccc2ccccc2c1)C(=O)Nc1ccc(F)cc1C(O)=O
C\C(=C/c1ccc2ccccc2c1Br)C(=O)Nc1ccc(F)cc1C(O)=O
C\C(=C/c1ccc2ccccc2c1Cl)C(=O)Nc1ccc(F)cc1C(O)=O
C\C(=C/c1ccc2ccccc2c1F)C(=O)Nc1ccc(F)cc1C(O)=O
C\C(=C/c1ccccc1)C(=O)Nc1ccccc1C(O)=O
C\C(CCC(=O)C(C)(C)O)=C/CC\C(C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O
C\C(CCC(=O)C(C)(C)O)=C/CC\C(C)=C\Cc1c(O)cc(C)c(C=O)c1O
C\C(CC[C@@H]1C(=C)CCC(=O)C1(C)C)=C/Cc1c(O)c(Cl)c(C)c(C(O)=O)c1O |r|
C\C(CC[C@@H]1C(=C)CC[C@H](O)C1(C)C)=C/Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C\C(CC[C@@H]1[C@@](C)(O)CCC(=O)C1(C)C)=C/Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C\C(CC[C@@H]1[C@](C)(O)CCC(=O)C1(C)C)=C/Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C\C(CC[C@H](O)C(C)(C)O)=C/CC\C(C)=C\Cc1c(O)c(Cl)c(C)c(C(O)=O)c1O |r|
C\C(CC[C@H](O)C(C)(C)O)=C/CC\C(C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C\C(CC[C@H](O)C(C)(C)O)=C/CC\C(C)=C\Cc1c(O)cc(C)c(C=O)c1O |r|
C\C(CC\C=C(/C)[C@@H]1C[C@H](O)C(C)(C)O1)=C/Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
C\C(O)=C(/C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
Cc1[nH]c(C(=O)N2CCC2)c(C)c1Cc1ccc(cn1)C(F)(F)F
Cc1[nH]c(C(=O)NC2CC2)c(C)c1Cc1ccc(nc1)C(F)(F)F
Cc1[nH]c(C(=O)NC2CC2)c(C)c1Oc1ccc(nc1)C(F)(F)F
Cc1[nH]c(C(=O)NC2CCC2)c(C)c1Cc1ccc(cn1)C(F)(F)F
Cc1[nH]c(C(=O)NC2CCC2)c(C)c1Cc1ccc(nc1)C(F)(F)F
Cc1[nH]c(cc1Cc1ccc(nc1)C(F)(F)F)C(=O)NC1CC1
Cc1[nH]c2ccc(cc2c1C)-c1nnc(SCC(=O)N2CCCC2)o1
Cc1c(C(=O)NCC(c2ccccc2)c2ccccc2)c(O)nn1C
Cc1c(CCCCc2ccccc2)nc2ccc(F)cc2c1C(O)=O
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cc(Cl)cc1Nc1nc2ccccc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cc(F)cc1Nc1nc2ccccc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1NC(=O)Nc1ccccc1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1NC(=O)c1nc2ccccc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2C(O)CCCc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2CCCC(=O)c2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2CCCC(O)c2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2CCCCCc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2CCCCc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2CCCc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2c(CCCC2=O)s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2c(CCC\C2=N/O)s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2ccccc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2cccnc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2ncccc2s1
Cc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2nccnc2s1
Cc1c(CO)c2cc(F)ccc2nc1-c1ccc(cc1)-c1ccccc1
Cc1c(CO)c2cc(F)ccc2nc1-c1ccc(cc1)-c1ccccc1F
Cc1c(Cc2ccc(F)c3ccncc23)c[nH]c1C(=O)N1CC(F)(F)C1
Cc1c(Cc2ccc(F)c3ccncc23)c[nH]c1C(=O)NC1CC1
Cc1c(Cc2ccc(cc2)C(F)(F)F)c[nH]c1C(=O)NC1CC1
Cc1c(Cc2ccc(cc2Cl)C(F)(F)F)c[nH]c1C(=O)NC1CC1
Cc1c(Cc2ccc(cc2F)C(F)(F)F)c[nH]c1C(=O)NC1CC1
Cc1c(Cc2ccc(nc2)C(F)(F)F)c(Cl)[nH]c1C(=O)NC1CC1
Cc1c(Cc2ccc(nc2)C(F)(F)F)c[nH]c1C(=O)C1CC1
Cc1c(Cc2ccc(nc2)C(F)(F)F)c[nH]c1C(=O)N1CC(F)(F)C1
Cc1c(Cc2ccc(nc2)C(F)(F)F)c[nH]c1C(=O)N1CC(F)C1
Cc1c(Cc2ccc(nc2)C(F)(F)F)c[nH]c1C(=O)N1CCC1
Cc1c(Cc2ccc(nc2)C(F)(F)F)c[nH]c1C(=O)NC(C)(C)C
Cc1c(Cc2ccc(nc2)C(F)(F)F)c[nH]c1C(=O)NC1CC1
Cc1c(Cc2ccc(nc2)C(F)(F)F)c[nH]c1C(=O)NC1CCC1
Cc1c(Cc2ccc(nc2)C(F)(F)F)c[nH]c1C(=O)NCC(F)(F)F
Cc1c(Cc2ccc(nc2F)C(F)(F)F)c[nH]c1C(=O)N1CC(F)(F)C1
Cc1c(Cc2ccc(nc2F)C(F)(F)F)c[nH]c1C(=O)NC1CC1
Cc1c(Cc2ccc(nc2F)C(F)(F)F)c[nH]c1C(=O)NCC(F)(F)F
Cc1c(Cc2cccc3ccncc23)c[nH]c1C(=O)N1CC(F)(F)C1
Cc1c(Cc2cccc3ccncc23)c[nH]c1C(=O)NC1CC1
Cc1c(Cc2cccc3ccncc23)c[nH]c1C(=O)NCC(F)(F)F
Cc1c(Cc2cnc(nc2)C(F)(F)F)c[nH]c1C(=O)NC1CC1
Cc1c(Cc2nc3ccccc3o2)c[nH]c1C(=O)NC1CC1
Cc1c(Cl)cccc1Nc1ncccc1C(O)=O
Cc1c(F)c(Nc2ncccc2C(O)=O)c(F)cc1-c1cccc(OC(F)(F)F)c1
Cc1c(F)c(Nc2ncccc2C(O)=O)c(F)cc1-c1ccccc1
Cc1c(F)c(Nc2ncccc2C(O)=O)c(F)cc1-c1ccccc1Cl
Cc1c(Nc2ccc(cc2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Cc1c(Nc2cccc(c2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Cc1c(Nc2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Cc1c(Nc2nc3C(O)CCCc3s2)cc(Cl)cc1OC1CCN(CC1)C(=O)CC(C(F)(F)F)C(F)(F)F
Cc1c(Nc2nc3CCCCc3s2)cc(Cl)cc1OC1CCN(CC1)C(=O)CC(C(F)(F)F)C(F)(F)F
Cc1c(Nc2nc3[C@@H](O)CCCc3s2)cc(Cl)cc1OC1CCN(CC1)C(=O)CC(C(F)(F)F)C(F)(F)F |r|
Cc1c(Nc2nc3[C@H](O)CCCc3s2)cc(Cl)cc1OC1CCN(CC1)C(=O)CC(C(F)(F)F)C(F)(F)F |r|
Cc1c(Nc2nc3c(CCCC3=O)s2)cc(Cl)cc1OC1CCN(CC1)C(=O)CC(C(F)(F)F)C(F)(F)F
Cc1c(Nc2nc3ccccc3s2)cc(Cl)cc1OC1CCN(CC1)C(=O)CC(C(F)(F)F)C(F)(F)F
Cc1c(Nc2nc3ccccc3s2)ccc(Cl)c1CN1CCN(CC1)C(=O)C1CCCC1
Cc1c(Nc2ncccc2C(O)=O)cccc1C(F)(F)F
Cc1c(O)c2cc(F)ccc2nc1-c1ccc(cc1)-c1ccccc1
Cc1c(O)c2cc(ccc2nc1C(=O)Nc1c(F)cc(cc1F)-c1cccc(F)c1)C(F)(F)F
Cc1c(OCc2ccc(cc2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Cc1c(OCc2cccc(c2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Cc1c(Oc2ccc(cc2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Cc1c(Oc2cccc(c2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Cc1c(Oc2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Cc1c(c[nH]c1C(=O)N1CC(F)(F)C1)C1(CC1)c1ccc(nc1)C(F)(F)F
Cc1c(c[nH]c1C(=O)NC1CC1)-c1c[nH]c2nc(ccc12)C(F)(F)F
Cc1c(c[nH]c1C(=O)NC1CC1)C(O)c1ccc(nc1)C(F)(F)F
Cc1c(c[nH]c1C(=O)NC1CC1)C1(CC1)c1ccc(nc1)C(F)(F)F
Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1cc(Cl)cc(Cl)c1
Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1ccc(Cl)c(Cl)c1
Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1ccc(F)c(Cl)c1
Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1ccc(F)c(F)c1
Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1cccc(Br)c1
Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1cccc(c1)C(F)(F)F
Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1cccc2ccccc12
Cc1c(nc2c(Cl)cccc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2cc(Cl)ccc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccc(Cl)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccc(Cl)cc2c1C(O)=O)-c1ccc(cc1)-c1cccnc1Cl
Cc1c(nc2ccc(Cl)cc2c1C(O)=O)-c1ccc(cc1)-c1cccnc1F
Cc1c(nc2ccc(F)cc2c1-c1nnn[nH]1)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1-c1noc(=O)[nH]1)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1-n1cnnn1)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C(=O)C(F)(F)F)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1C(=O)NC#N)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1C(=O)NO)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1C(=O)NS(C)(=O)=O)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1C(F)F)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1C(N)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C(N)=O)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(Oc2ccccc2)cc1
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1cccnc1Cl
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1cccnc1F
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)C(C)(C)C
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)C1CCCCC1
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(s1)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc2ccccc2c1
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1cccc(Oc2ccccc2)c1
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1cccc(c1)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1cccc2ccccc12
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C(O)=O)C(=O)Nc1c(F)cc(cc1F)-c1cccc(F)c1
Cc1c(nc2ccc(F)cc2c1C(O)C(F)(F)F)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1c[nH]c2c(cccc12)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1ccc(Br)cc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1ccc(Cl)cc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1ccc(F)cc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1ccc(O)cc1F
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1ccc(cc1)C(F)(F)F
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1cccc(F)c1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1cccnc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1cccs1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-n1ccnc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1cccc2c(cccc12)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1cn(C)c2c(cccc12)-c1cccc(c1)C(F)(F)F
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1cn(C)c2c(cccc12)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-n1ccc2c(cccc12)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)-n1cnc2c(cccc12)-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)N1CCc2c1cc(F)cc2-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)N1CCc2c1cccc2-c1cccc(c1)C(F)(F)F
Cc1c(nc2ccc(F)cc2c1C([O-])=O)N1CCc2c1cccc2-c1ccccc1
Cc1c(nc2ccc(F)cc2c1C([O-])=O)N1CCc2c1cccc2-c1ccccc1F
Cc1c(nc2ccc(O)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccc(OC(F)(F)F)cc2c1C(O)=O)C(=O)Nc1c(F)cc(cc1F)-c1cccc(F)c1
Cc1c(nc2ccc(cc2c1C(O)=O)C(F)(F)F)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccc(cc2c1C(O)=O)C(F)(F)F)C(=O)Nc1c(F)cc(cc1F)-c1cccc(F)c1
Cc1c(nc2cccc(Cl)c2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccccc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccccc2c1C(O)=O)-c1ccc(cc1)-c1cccnc1Cl
Cc1c(nc2ccccc2c1C(O)=O)-c1ccc(cc1)-c1cccnc1F
Cc1c(nc2cccnc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ccncc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ccncc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2cnc(cc2c1C(O)=O)C(F)(F)F)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2cnc(cc2c1C(O)=O)C(F)(F)F)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2cnc(cc2c1C(O)=O)C(F)(F)F)-c1ccc(cc1)-c1cccnc1Cl
Cc1c(nc2cnccc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2cnccc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2cnccc2c1C(O)=O)-c1ccc(cc1)-c1cccnc1Cl
Cc1c(nc2nc[nH]c2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F
Cc1c(nc2ncccc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Cc1c(nc2ncccc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F
Cc1cc(-c2nnn[nH]2)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F
Cc1cc(=O)n2[nH]c(SCc3c(Cl)cccc3Cl)nc2n1
Cc1cc(=O)n2[nH]c(SCc3cc(Cl)ccc3Cl)nc2n1
Cc1cc(=O)n2[nH]c(SCc3ccc(Br)cc3)nc2n1
Cc1cc(=O)n2[nH]c(SCc3ccc(Cl)c(Cl)c3)nc2n1
Cc1cc(=O)n2[nH]c(SCc3ccc(Cl)cc3)nc2n1
Cc1cc(=O)n2[nH]c(SCc3cccc(Cl)c3)nc2n1
Cc1cc(=O)n2[nH]c(SCc3ccccc3)nc2n1
Cc1cc(=O)n2[nH]c(SCc3ccccc3Cl)nc2n1
Cc1cc(=O)n2[nH]c(SCc3ccccc3[N+]([O-])=O)nc2n1
Cc1cc(Br)cc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1
Cc1cc(Br)ccc1NC(=O)c1ccc2ccccc2c1
Cc1cc(C#N)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F
Cc1cc(C(N)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F
Cc1cc(C(N)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(nc1)C(=O)N1CCCC1
Cc1cc(C(N)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccccc1
Cc1cc(C(N)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1cncc(c1)C(=O)N1CCCC1
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1c(F)c(F)c(-c2ccc(O)cc2)c(F)c1F
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1c(F)c(F)c(-c2cccc(F)c2)c(F)c1F
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1c(F)c(F)c(-c2cccc(O)c2)c(F)c1F
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1c(F)c(F)c(-c2cccc(OCc3ccccc3)c2)c(F)c1F
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1c(F)c(F)c(c(F)c1F)-c1ccccc1OCc1ccccc1 |(-7.81,-4.21,;-6.47,-3.44,;-6.47,-1.9,;-5.14,-1.13,;-5.14,.41,;-3.8,1.18,;-6.47,1.18,;-3.8,-1.9,;-2.34,-1.42,;-1.43,-2.67,;-2.34,-3.91,;-3.8,-3.44,;-5.14,-4.21,;.11,-2.67,;.88,-1.33,;.11,,;2.42,-1.33,;3.19,,;3.19,-2.67,;2.42,-4,;3.19,-5.33,;.88,-4,;.11,-5.33,;4.73,-2.67,;5.5,-4,;7.04,-4,;7.81,-2.67,;7.04,-1.33,;5.5,-1.33,;4.73,,;5.5,1.33,;4.73,2.67,;5.5,4,;4.73,5.33,;3.19,5.33,;2.42,4,;3.19,2.67,)|
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(Oc2ccccc2)cc1
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1)-c1c(F)cccc1F
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1)-c1ccc(F)cc1F
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1)-c1ccc(O)c(O)c1
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1)-c1ccc(OCCC2CCNCC2)cc1
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1)-c1ccc(OCCO)cc1
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1)-c1ccccc1F
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1)-c1ccccc1OCc1ccccc1
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1F)-c1ccc(F)cc1F
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1F)-c1ccccc1
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(cc1F)-c1ccccc1F
Cc1cc(C(O)=O)c2[nH]c(nc2c1)-c1ccc(nc1)-c1ccccc1
Cc1cc(C(O)=O)c2n(C)c(nc2c1)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F |(-7.81,-2.13,;-6.47,-1.36,;-6.47,.18,;-5.14,.95,;-5.14,2.49,;-3.8,3.26,;-6.47,3.26,;-3.8,.18,;-2.34,.65,;-1.57,1.99,;-1.43,-.59,;-2.34,-1.84,;-3.8,-1.36,;-5.14,-2.13,;.11,-.59,;.88,.74,;.11,2.08,;2.42,.74,;3.19,2.08,;3.19,-.59,;4.73,-.59,;5.5,-1.93,;7.04,-1.93,;7.81,-.59,;7.04,.74,;5.5,.74,;2.42,-1.93,;3.19,-3.26,;.88,-1.93,;.11,-3.26,)|
Cc1cc(C(O)=O)c2n(CCO)c(nc2c1)-c1c(F)c(F)c(-c2ccc(O)cc2)c(F)c1F |(-8.58,-2.83,;-7.24,-2.06,;-7.24,-.52,;-5.91,.25,;-5.91,1.79,;-7.24,2.56,;-4.57,2.56,;-4.57,-.52,;-3.11,-.04,;-2.34,1.29,;-3.11,2.62,;-2.34,3.96,;-2.2,-1.29,;-3.11,-2.54,;-4.57,-2.06,;-5.91,-2.83,;-.66,-1.29,;.11,.04,;-.66,1.38,;1.65,.04,;2.42,1.38,;2.42,-1.29,;3.96,-1.29,;4.73,-2.62,;6.27,-2.62,;7.04,-1.29,;8.58,-1.29,;6.27,.04,;4.73,.04,;1.65,-2.62,;2.42,-3.96,;.11,-2.62,;-.66,-3.96,)|
Cc1cc(C(O)=O)c2n(CCO)c(nc2c1)-c1ccc(cc1)-c1ccc(O)cc1
Cc1cc(C(O)=O)c2nc(-c3c(F)c(F)c(-c4ccccc4)c(F)c3F)n(C)c2c1 |(-7.81,-2.13,;-6.47,-1.36,;-6.47,.18,;-5.14,.95,;-5.14,2.49,;-3.8,3.26,;-6.47,3.26,;-3.8,.18,;-2.34,.65,;-1.43,-.59,;.11,-.59,;.88,.74,;.11,2.08,;2.42,.74,;3.19,2.08,;3.19,-.59,;4.73,-.59,;5.5,-1.93,;7.04,-1.93,;7.81,-.59,;7.04,.74,;5.5,.74,;2.42,-1.92,;3.19,-3.26,;.88,-1.92,;.11,-3.26,;-2.34,-1.84,;-1.57,-3.17,;-3.8,-1.36,;-5.14,-2.13,)|
Cc1cc(C(O)=O)c2nc(-c3ccc(cc3)-c3ccccc3)n(CCO)c2c1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2cc(F)cc(F)c2)c(F)c1F
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccc(CN3CCCCC3)cc2)c(F)c1F
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccc(F)c(F)c2)c(F)c1F
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccc(F)cc2)c(F)c1F
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccc(OCc3ccccc3)cc2)c(F)c1F
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2cccnc2)c(F)c1F
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccsc2)c(F)c1F
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(c(F)c1F)-c1ccc(NC(=O)C2CCCN2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(c(F)c1F)-c1cccc(NC(=O)C2CCCN2)c1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(c(F)c1F)-c1ccccc1F |(-7.81,-2.13,;-6.47,-1.36,;-6.47,.18,;-5.14,.95,;-5.14,2.49,;-6.47,3.26,;-3.8,3.26,;-3.8,.18,;-2.34,.65,;-1.43,-.59,;-2.34,-1.84,;-3.8,-1.36,;-5.14,-2.13,;.11,-.59,;.88,.74,;.11,2.08,;2.42,.74,;3.19,2.08,;3.19,-.59,;2.42,-1.92,;3.19,-3.26,;.88,-1.92,;.11,-3.26,;4.73,-.59,;5.5,-1.93,;7.04,-1.93,;7.81,-.59,;7.04,.74,;5.5,.74,;4.73,2.08,)|
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)cc(cc1F)-c1ccccc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(Oc2ccccn2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(NC(=O)C2CCCN2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(NC(=O)C2CCNCC2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(O)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(OCCCN2CCCCC2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(OCCCN2CCOCC2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(OCc2ccccc2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(OCc2ccccn2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(OCc2cccnc2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(OCc2ccncc2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(Oc2ccc(C=O)cc2)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(Oc2ccccc2C#N)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(Oc2ccccc2C(O)=O)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(Oc2ccccc2C=O)cc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccc(cc1)C(=O)NC1CCNCC1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1cccc(F)c1F
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1cccc(O)c1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1cccc(OCc2ccccc2)c1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1ccccc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1cccnc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1cccs1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1cnccn1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cc1)-c1cnn(Cc2ccccc2)c1
Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1ccc(cn1)-c1ccccc1
Cc1cc(C(O)=O)c2nc([nH]c2c1)C#Cc1ccccc1
Cc1cc(C)c2nc(c(O)c(C(O)=O)c2c1)-c1ccc(Cl)cc1
Cc1cc(C)cc(CSc2nc3nc(C)cc(=O)n3[nH]2)c1
Cc1cc(C)cc(Nc2cc(C)nc3nc(nn23)C(F)(F)F)c1
Cc1cc(Cl)ccc1NC(=O)C(C#N)C(=O)C1CC1
Cc1cc(F)c2n(cnc2c1)-c1ccc(s1)C(=O)NC1CC1
Cc1cc(F)c2ncn(-c3ccc(s3)C(=O)NC3CC3)c2c1
Cc1cc(N(Cc2ccccc2)c2ccc3ccccc3c2)n2ncnc2n1
Cc1cc(N)n2nc(SCc3ccc(Cl)c(Cl)c3)nc2n1
Cc1cc(N)n2nc(SCc3ccccc3)nc2n1
Cc1cc(NC(=O)C(C#N)C(=O)C2CC2)ccc1Br
Cc1cc(NC(=O)C(C#N)C(=O)C2CC2)ccc1C#N
Cc1cc(NC(=O)C(C#N)C(=O)C2CC2)ccc1C(F)(F)C(F)(F)F
Cc1cc(NC(=O)C(C#N)C(=O)C2CC2)ccc1C(F)(F)F
Cc1cc(NC(=O)C(C#N)C(=O)C2CC2)ccc1Cl
Cc1cc(NC(=O)C(C#N)C(=O)C2CC2)ccc1OC(F)(F)F
Cc1cc(NC(=O)C(C#N)C(=O)C2CC2)ccc1SC(F)(F)F
Cc1cc(NC(=O)c2c(O)nn3ccccc23)c(OC2CCC2)cc1Oc1ccccc1
Cc1cc(NC(=O)c2c(O)nn3ccccc23)ccc1Oc1ccccc1
Cc1cc(NC(=O)c2ccc(cc2)C(F)(F)F)n2ncnc2n1
Cc1cc(NC(=O)c2ccccc2)n2ncnc2n1
Cc1cc(NC2CC2)n2ncnc2n1
Cc1cc(NC2CCC2)n2ncnc2n1
Cc1cc(NC2CCCC2)n2ncnc2n1
Cc1cc(NC2CCCCC2)n2ncnc2n1
Cc1cc(NC2CCCCCC2)n2ncnc2n1
Cc1cc(NC2CCCCCCC2)n2ncnc2n1
Cc1cc(NC2CCCCCCCCCCC2)n2ncnc2n1
Cc1cc(NC2CCc3cc(Br)ccc3C2)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2CCc3cc(Cl)ccc3C2)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2CCc3cc(Cl)ccc3C2)n2ncnc2n1
Cc1cc(NC2CCc3cc(F)c(cc3C2)C(F)(F)F)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2CCc3cc(F)ccc3C2)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2CCc3cc(F)ccc3C2)n2ncnc2n1
Cc1cc(NC2CCc3cc(c(F)cc3C2)C(F)(F)F)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2CCc3ccc(Br)cc3C2)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2CCc3ccc(Cl)cc3C2)n2nc(nc2n1)C(F)(F)F
Cc1cc(NC2CCc3ccccc3C2)n2nc(nc2n1)C(F)(F)F
Cc1cc(NC2CCc3ccccc3C2)n2ncnc2n1
Cc1cc(NC2Cc3c(C2)c(C)ccc3C)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2Cc3c(C2)c(F)ccc3F)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2Cc3cc(CO)c(CO)cc3C2)n2ncnc2n1
Cc1cc(NC2Cc3cc(Cl)c(Cl)cc3C2)n2ncnc2n1
Cc1cc(NC2Cc3cc(F)c(F)cc3C2)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2Cc3cc(F)c(F)cc3C2)n2ncnc2n1
Cc1cc(NC2Cc3ccc(Br)cc3C2)n2ncnc2n1
Cc1cc(NC2Cc3ccc(F)cc3C2)n2ncnc2n1
Cc1cc(NC2Cc3cccc(F)c3C2)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2Cc3cccc(c3C2)C(F)(F)F)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2Cc3ccccc3C2)n2nc(nc2n1)C(C)(F)F
Cc1cc(NC2Cc3ccccc3C2)n2ncnc2n1
Cc1cc(NCCCc2ccccc2)n2ncnc2n1
Cc1cc(NCCc2ccccc2)n2ncnc2n1
Cc1cc(NCc2ccc(F)cc2)n2ncnc2n1
Cc1cc(NCc2ccc(cc2)C(F)(F)F)n2ncnc2n1
Cc1cc(NCc2ccccc2)n2nc(SCc3ccccc3)nc2n1
Cc1cc(NCc2ccccc2)n2ncnc2n1
Cc1cc(NOc2ccccc2)n2ncnc2n1
Cc1cc(N[C@@H]2CCc3ccc(Cl)cc3C2)n2nc(nc2n1)C(C)(F)F |r|
Cc1cc(N[C@H]2CCc3ccc(Cl)cc3C2)n2nc(nc2n1)C(C)(F)F |r|
Cc1cc(Nc2c(F)c(F)c(F)c(F)c2F)n2ncnc2n1
Cc1cc(Nc2c(F)c(F)cc(F)c2F)n2ncnc2n1
Cc1cc(Nc2c(F)cc(F)cc2F)n2ncnc2n1
Cc1cc(Nc2c(F)cccc2F)n2ncnc2n1
Cc1cc(Nc2cc(F)c(F)cc2F)n2ncnc2n1
Cc1cc(Nc2cc(F)c(c(F)c2)C(F)(F)F)n2nc(nc2n1)C(C)(F)F
Cc1cc(Nc2cc(F)c(c(F)c2)C(F)(F)F)n2nc(nc2n1)C(F)(F)F
Cc1cc(Nc2cc(F)c(c(F)c2)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2cc(F)cc(F)c2)n2ncnc2n1
Cc1cc(Nc2cc(F)ccc2F)n2ncnc2n1
Cc1cc(Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2cc3ccccc3cc2O)n2ncnc2n1
Cc1cc(Nc2ccc(Br)c(c2)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccc(Br)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(C#N)c(c2)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccc(C)c(C)c2)n2ncnc2n1
Cc1cc(Nc2ccc(C)c(Cl)c2)n2nc(nc2n1)C(F)(F)F
Cc1cc(Nc2ccc(C)c(F)c2)n2ncnc2n1
Cc1cc(Nc2ccc(C)c(c2)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccc(C=C)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(CC(F)(F)F)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(Cc3ccccc3)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(Cl)c(F)c2)n2nc(nc2n1)C(F)(F)F
Cc1cc(Nc2ccc(Cl)c(F)c2)n2ncnc2n1
Cc1cc(Nc2ccc(Cl)c(c2)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccc(Cl)cc2)n2nc(nc2n1)C(C)(F)F
Cc1cc(Nc2ccc(Cl)cc2)n2nc(nc2n1)C(F)(F)F
Cc1cc(Nc2ccc(Cl)cc2)n2nc(nc2n1)C1CC1
Cc1cc(Nc2ccc(Cl)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(F)c(C)c2)n2ncnc2n1
Cc1cc(Nc2ccc(F)c(F)c2)n2ncnc2n1
Cc1cc(Nc2ccc(F)c(F)c2F)n2ncnc2n1
Cc1cc(Nc2ccc(F)cc2)n2nc(nc2n1)C(F)(F)F
Cc1cc(Nc2ccc(F)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(NC(C)(C)C)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(OC(C)(C)C)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(OC(F)(F)F)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(OC(F)F)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(OCc3ccccc3)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(SC(F)(F)F)cc2)n2ncnc2n1
Cc1cc(Nc2ccc(c(F)c2)C(C)(C)C)n2ncnc2n1
Cc1cc(Nc2ccc(c(F)c2)C(F)(F)F)n2ccnc2n1
Cc1cc(Nc2ccc(c(F)c2)C(F)(F)F)n2nc(nc2n1)C(C)(F)F
Cc1cc(Nc2ccc(c(F)c2)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccc(c(F)c2)S(F)(F)(F)(F)F)n2nc(nc2n1)C(C)(F)F
Cc1cc(Nc2ccc(c(c2)C(F)(F)F)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)-c2ccccc2)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)C#C)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)C(C)(C)C#N)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)C(C)(C)C)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)C(F)(F)F)[nH]n1
Cc1cc(Nc2ccc(cc2)C(F)(F)F)n2ccnc2n1
Cc1cc(Nc2ccc(cc2)C(F)(F)F)n2nc(nc2n1)C(C)(C)C
Cc1cc(Nc2ccc(cc2)C(F)(F)F)n2nc(nc2n1)C(C)(F)F
Cc1cc(Nc2ccc(cc2)C(F)(F)F)n2nc(nc2n1)C(F)(F)F
Cc1cc(Nc2ccc(cc2)C(F)(F)F)n2nc(nc2n1)C1CC1
Cc1cc(Nc2ccc(cc2)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)C(N)=O)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)C2CC2)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)N2CCCC2)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)N2CCOCC2)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)S(F)(F)(F)(F)F)n2ccnc2n1
Cc1cc(Nc2ccc(cc2)S(F)(F)(F)(F)F)n2nc(nc2n1)C(C)(C)C
Cc1cc(Nc2ccc(cc2)S(F)(F)(F)(F)F)n2nc(nc2n1)C(C)(F)F
Cc1cc(Nc2ccc(cc2)S(F)(F)(F)(F)F)n2nc(nc2n1)C(F)(F)F
Cc1cc(Nc2ccc(cc2)S(F)(F)(F)(F)F)n2nc(nc2n1)C1CC1
Cc1cc(Nc2ccc(cc2)S(F)(F)(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccc(cc2)[N+]([O-])=O)n2ncnc2n1
Cc1cc(Nc2ccc(cc2C(O)=O)C2CC2)cnc1-c1cccc(OC(F)(F)F)c1
Cc1cc(Nc2ccc(cc2C(O)=O)C2CC2)cnc1-c1ccccc1
Cc1cc(Nc2ccc(nc2)C(F)(F)F)n2nc(nc2n1)C(C)(F)F
Cc1cc(Nc2ccc3CCCCc3c2)n2nc(nc2n1)C(F)(F)F
Cc1cc(Nc2ccc3CCCCc3c2)n2ncnc2n1
Cc1cc(Nc2ccc3CCCc3c2)n2ccnc2n1
Cc1cc(Nc2ccc3CCCc3c2)n2ncnc2n1
Cc1cc(Nc2ccc3OCOc3c2)n2ncnc2n1
Cc1cc(Nc2ccc3c(c2)oc(C)cc3=O)n2ncnc2n1
Cc1cc(Nc2ccc3cc4ccccc4cc3c2)n2ncnc2n1
Cc1cc(Nc2ccc3ccccc3c2)n2ccnc2n1
Cc1cc(Nc2ccc3ccccc3c2)n2nccc2n1
Cc1cc(Nc2ccc3ccccc3c2)n2ncnc2n1
Cc1cc(Nc2ccc3nc([nH]c3c2)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccc3ncccc3c2)n2ncnc2n1
Cc1cc(Nc2ccc3sccc3c2)n2ncnc2n1
Cc1cc(Nc2cccc(Cl)c2)n2nc(nc2n1)C1CC1
Cc1cc(Nc2cccc(Cl)c2)n2ncnc2n1
Cc1cc(Nc2cccc(F)c2)n2ncnc2n1
Cc1cc(Nc2cccc(F)c2F)n2ncnc2n1
Cc1cc(Nc2cccc(c2)C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2cccc3ccccc23)n2ncnc2n1
Cc1cc(Nc2ccccc2)n2ncnc2n1
Cc1cc(Nc2ccccc2C#N)n2ncnc2n1
Cc1cc(Nc2ccccc2C(F)(F)F)n2ncnc2n1
Cc1cc(Nc2ccccc2C)n2ncnc2n1
Cc1cc(Nc2ccccc2Cl)n2ncnc2n1
Cc1cc(Nc2ccccc2F)n2ncnc2n1
Cc1cc(Nc2cnc3ccccc3c2)n2ncnc2n1
Cc1cc(Oc2ccccc2)c(C)cc1NC(=O)c1c(O)nn2ccccc12
Cc1cc(Oc2ccccc2)ccc1NC(=O)c1c(O)nn2ccccc12
Cc1cc(Sc2ccncc2)c(C)cc1NC(=O)c1c(O)nn2ccccc12
Cc1cc(c(C(=O)C(=O)Nc2ccc(cc2)N2CCN(CC2)c2ncc(F)cn2)n1C)-c1ccccc1
Cc1cc(cc(C)c1Oc1ccccc1)-c1cc(C(O)=O)c2cc(F)ccc2n1
Cc1cc(ccc1F)-n1nnc2c1C(=O)c1ccccc1C2=O
Cc1cc(ccc1NC(=O)C1=C(CCC1)C(O)=O)-c1cccc(OC(F)(F)F)c1 |t:11|
Cc1cc(ccn1)-c1ccc(cc1)-c1nc2ccncc2c(O)c1C#N
Cc1cc(ccn1)-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
Cc1cc(no1)C(=O)NC1CCCc2c1cnn2-c1ccc(C)c(C)c1
Cc1ccc(C)c(c1)\N=C\c1cccc(O)c1O
Cc1ccc(C)n1-c1c(F)c(F)c(-c2nc3cc(C)cc(C(O)=O)c3[nH]2)c(F)c1F |(5.22,-3.17,;5.99,-1.84,;7.45,-1.36,;7.45,.18,;5.99,.65,;5.22,1.99,;5.08,-.59,;3.54,-.59,;2.77,.74,;3.54,2.08,;1.23,.74,;.46,2.08,;.46,-.59,;-1.08,-.59,;-1.98,-1.84,;-3.45,-1.36,;-4.78,-2.13,;-6.12,-1.36,;-7.45,-2.13,;-6.12,.18,;-4.78,.95,;-4.78,2.49,;-3.45,3.26,;-6.12,3.26,;-3.45,.18,;-1.98,.65,;1.23,-1.93,;.46,-3.26,;2.77,-1.93,;3.54,-3.26,)|
Cc1ccc(C)n1-c1c(F)c(F)c(-c2nc3cccc(C(O)=O)c3[nH]2)c(F)c1F |(4.55,-3.17,;5.32,-1.84,;6.78,-1.36,;6.78,.18,;5.32,.65,;4.55,1.99,;4.41,-.59,;2.87,-.59,;2.1,.74,;2.87,2.08,;.56,.74,;-.21,2.08,;-.21,-.59,;-1.75,-.59,;-2.65,-1.84,;-4.12,-1.36,;-5.45,-2.13,;-6.78,-1.36,;-6.78,.18,;-5.45,.95,;-5.45,2.49,;-4.12,3.26,;-6.78,3.26,;-4.12,.18,;-2.65,.65,;.56,-1.92,;-.21,-3.26,;2.1,-1.92,;2.87,-3.26,)|
Cc1ccc(C)n1-c1ccc(cc1)-c1cc(C(O)=O)c2n(C)nnc2c1
Cc1ccc(C)n1-c1ccc(cc1)-c1cc(C(O)=O)c2nn(C)nc2c1
Cc1ccc(C)n1-c1ccc(cc1)-c1nc2cc(C)cc(C(O)=O)c2[nH]1
Cc1ccc(CNC(=O)c2cc(C(=O)Nc3ccccc3)n(n2)-c2ccc(Cl)cc2)cc1
Cc1ccc(CSc2nc3nc(C)cc(=O)n3[nH]2)cc1
Cc1ccc(F)c(c1)-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(ccn1)C(F)(F)F |r|
Cc1ccc(F)c(c1)-n1ncc2[C@@H](CCCc12)NC(=O)c1onc2CCCCc12 |r|
Cc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
Cc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1Cl
Cc1ccc(NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H]2Cc3ccccc3CN2)cc1 |r|
Cc1ccc(NC(=O)c2ccc3ccccc3c2)c(Cl)c1
Cc1ccc(Nc2c3CCCc3nc3ncnn23)cc1F
Cc1ccc(Nc2cc(C)nc3ncnn23)c(F)c1
Cc1ccc(Nc2cc(C)nc3ncnn23)cc1
Cc1ccc(Nc2cc(Cl)cnc2-c2ccccc2)c(c1)C(O)=O
Cc1ccc(Nc2cc(O)cs2)cc1C
Cc1ccc(Nc2ccc(nc2)-c2c(F)ccc(F)c2F)c(c1)C(O)=O
Cc1ccc(Nc2ccc(nc2)-c2c(F)cccc2F)c(c1)C(O)=O
Cc1ccc(Nc2ccc(nc2)-c2ccc(F)cc2F)c(c1)C(O)=O
Cc1ccc(Nc2ccc(nc2)-c2cccc(c2)C(F)(F)F)c(c1)C(O)=O
Cc1ccc(Nc2ccc(nc2)-c2ccccc2Cl)c(c1)C(O)=O
Cc1ccc(Nc2ccc(nc2)-c2ccccc2F)c(c1)C(O)=O
Cc1ccc(Nc2ccc(nc2)-c2ccncc2Cl)c(c1)C(O)=O
Cc1ccc(Nc2ccc(nc2)-c2ccncc2F)c(c1)C(O)=O
Cc1ccc(Nc2cnc(N3CCCCC3)c(C)c2)c(c1)C(O)=O
Cc1ccc(Nc2cnc(N3CCCCCC3)c(C)c2)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(C)c2)-c2cccc(Cl)c2)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(C)c2)-c2cccc(c2)C(=O)N2CCCC2)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(C)c2)-c2cccc(c2)C(=O)NC2CC2)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(C)c2)-c2cccc(c2)C(N)=O)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(C)c2)-c2ccccc2)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(C)c2)-c2ccccc2C(F)(F)F)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(C)c2)-c2ccccc2Cl)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(C)c2)-c2ccccc2F)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(C)c2)-c2ccncc2F)c(c1)C(O)=O
Cc1ccc(Nc2cnc(c(F)c2)-c2ccccc2)c(c1)C(O)=O
Cc1ccc(Nc2cnc(nc2)-c2ccccc2Cl)c(c1)C(O)=O
Cc1ccc(Nc2nc3ccccc3s2)c(C)c1CN1CCN(CC1)C(=O)C1CCCC1
Cc1ccc(Nc2scc(O)c2C(=O)NC2CC2)cc1C
Cc1ccc(Nc2scc(O)c2C(=O)NCC2CC2)cc1C
Cc1ccc(Nc2scc(O)c2C(=O)OCC2CC2)cc1C
Cc1ccc(Nc2scc(O)c2C(N)=O)cc1C
Cc1ccc(Nc2scc(O)c2C(O)=O)cc1C
Cc1ccc(\C=C2/COc3cc4ccccc4cc3C2=O)cc1
Cc1ccc(\C=C2/SC(=S)N(Cc3ccccc3)C2=O)o1
Cc1ccc(c(Cl)n1)-c1ccc(cc1)-c1cc(C(O)=O)c2ccccc2n1
Cc1ccc(c(Cl)n1)-c1ccc(cc1)-c1nc2ccc(Cl)cc2c(C(O)=O)c1C
Cc1ccc(c(Cl)n1)-c1ccc(cc1)-c1nc2ccc(F)cc2c(C(O)=O)c1C
Cc1ccc(c(Cl)n1)-c1ccc(cc1)-c1nc2ccccc2c(C(O)=O)c1C
Cc1ccc(c(Cl)n1)-c1ccc(cc1)-c1nc2cnccc2c(C(O)=O)c1C
Cc1ccc(c(F)n1)-c1ccc(cc1)-c1nc2ccc(F)cc2c(C(O)=O)c1C
Cc1ccc(c(F)n1)-c1ccc(cc1)-c1nc2ccccc2c(C(O)=O)c1C
Cc1ccc(cc1)-c1cc(C(O)=O)c2cc(Cl)ccc2n1
Cc1ccc(cc1)-c1ccc(cc1)-c1cc(cc(c1)C(O)=O)C(N)=O
Cc1ccc(cc1)-c1ccc(cc1)-c1nc2ccc(F)cc2c(C([O-])=O)c1C
Cc1ccc(cc1)-c1ccc-2c(CCc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
Cc1ccc(cc1)-c1ccc-2c(CSc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
Cc1ccc(cc1)-c1ccc-2c(SCc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
Cc1ccc(cc1)-c1cccc(c1)-c1cc(cc(c1)C(O)=O)C(N)=O
Cc1ccc(cc1)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
Cc1ccc(cc1C(F)(F)F)-n1nnc2c1C(=O)c1ccccc1C2=O
Cc1ccc(nc1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1C |r|
Cc1ccc(nc1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r|
Cc1ccc2c(C(O)=O)c(O)c(nc2c1)-c1ccc(Cl)cc1
Cc1ccc2c(C(O)=O)c(O)c(nc2c1C)-c1ccc(Br)cc1
Cc1ccc2c(C(O)=O)c(O)c(nc2c1C)-c1ccc(Cl)cc1
Cc1ccc2c(C(O)=O)c(O)c(nc2c1C)-c1ccc(cc1)C(F)(F)F
Cc1ccc2n(cnc2c1)-c1ccc(s1)C(=O)NC1CC1
Cc1ccc2nc(c(C)c(C(O)=O)c2c1)-c1ccc(cc1)-c1ccccc1
Cc1ccc2nc(c(C)c(C(O)=O)c2c1)-c1ccc(cc1)-c1cccnc1Cl
Cc1ccc2nc(c(O)c(C(O)=O)c2c1)-c1ccc(Cl)cc1
Cc1ccc2nc(cc(C(=O)OCc3ccccc3)c2c1)-c1ccc(Cl)cc1
Cc1ccc2nc(cc(C(=O)OCc3ccccc3)c2c1)-c1ccc(F)cc1
Cc1ccc2nc(cc(COCc3ccccc3)c2c1)-c1ccc(F)cc1
Cc1cccc(C)c1NC1=C(O)C(=O)c2ccccc2C1=O |c:10|
Cc1cccc(NC(=O)c2cccc(c2C)[N+]([O-])=O)c1
Cc1cccc(Nc2cc(C)nc3ncnn23)c1
Cc1cccc(c1)-c1ccc-2c(CCc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
Cc1cccc(c1)-c1ccc-2c(CCc3c-2nc2ccc(F)cc2c3C([O-])=O)n1
Cc1cccc(c1)-c1ccc-2c(CSc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
Cc1cccc(c1)-c1ccc-2c(SCc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
Cc1cccc(c1)-c1cccc(c1)-c1cc(cc(c1)C(O)=O)C(N)=O
Cc1cccc(c1)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12
Cc1cccc(c1C)-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12
Cc1cccc(n1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1C |r|
Cc1cccc2c(C(=O)Nc3c(F)c(F)c(-c4ccccc4)c(F)c3F)c(O)nn12
Cc1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1
Cc1cccc2nc(c(O)c(C(O)=O)c12)-c1ccc(Cl)cc1
Cc1ccccc1-c1cc(F)c(Nc2ncccc2C(O)=O)c(F)c1
Cc1ccccc1-c1ccc(cc1)-c1cc(C(N)=O)c2n(C)nnc2c1
Cc1ccccc1-c1ccc(cc1)-c1cc(C(N)=O)c2nn(C)nc2c1
Cc1ccccc1-c1ccc(cc1)-c1cc(C(O)=O)c2n(C)nnc2c1
Cc1ccccc1-c1ccc(cc1)-c1cc(C(O)=O)c2nn(C)nc2c1
Cc1ccccc1-c1ccc-2c(CCc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
Cc1ccccc1-c1ccc-2c(CSc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
Cc1ccccc1-c1ccc-2c(SCc3c-2nc2ccc(F)cc2c3C([O-])=O)c1
Cc1ccccc1-c1cccc2N(CCc12)c1nc2ccc(F)cc2c(C([O-])=O)c1C
Cc1ccccc1-c1ncc(Nc2ccc(cc2C(O)=O)C2CC2)cn1
Cc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1noc2CCCCc12
Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)C1=CC2C=CC=CC2O1 |r,c:25,27,t:22|
Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ccccn1 |r|
Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cccnc1O |r|
Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ncccc1C |r|
Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r|
Cc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1onc2CCCCc12 |r|
Cc1ccccc1C(=O)Nc1cc(Cl)c(O)c(Cl)c1
Cc1ccccc1C=Cc1cc(O)c2ccccc2n1 |w:7.7|
Cc1ccccc1NC(=O)c1cccc2nc([nH]c12)-c1cc(Br)nn1-c1ncccc1Cl
Cc1ccn2nc(O)c(C(=O)Nc3c(F)c(F)c(-c4ccccc4)c(F)c3F)c2c1
Cc1ccnc(c1)C(=O)NC1CCCc2c1cnn2-c1ccccc1
Cc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1cc(C)ccc1F |r|
Cc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1C |r|
Cc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r|
Cc1ccncc1-c1ccc(cc1)-c1cc(C(O)=O)c2ccccc2n1
Cc1ccsc1C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1C |r|
Cc1cnc(Nc2ccc(cc2F)-c2cccc(OC(F)(F)F)c2)c(c1)C(O)=O
Cc1cnc(cc1C)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r|
Cc1cnc(cn1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r|
Cc1n[nH]c(NCc2ccc(cc2)C(F)(F)F)c1C#N
Cc1n[nH]c(Nc2c(F)cc(F)cc2F)c1C#N
Cc1n[nH]c(Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1C#N
Cc1n[nH]c(Nc2ccc(C)cc2)c1C#N
Cc1n[nH]c(Nc2ccc(F)cc2)c1C#N
Cc1n[nH]c(Nc2ccc(N)cc2)c1C#N
Cc1n[nH]c(Nc2ccc(OC(F)(F)F)cc2)c1C#N
Cc1n[nH]c(Nc2ccc(c(Br)c2)C(F)(F)F)c1C#N
Cc1n[nH]c(Nc2ccc(cc2)C#N)c1C#N
Cc1n[nH]c(Nc2ccc(cc2)C(C)(C)C)c1C#N
Cc1n[nH]c(Nc2ccc(cc2)C(F)(F)F)c1-c1ccccc1
Cc1n[nH]c(Nc2ccc(cc2)C(F)(F)F)c1C
Cc1n[nH]c(Nc2ccc(cc2)C(F)(F)F)c1C#N
Cc1n[nH]c(Nc2ccc(cc2)C(F)(F)F)c1CO
Cc1n[nH]c(Nc2ccc(cc2)[N+]([O-])=O)c1C#N
Cc1n[nH]c(Nc2cccc(c2)C(F)(F)F)c1C#N
Cc1n[nH]c(Nc2ccccc2)c1C#N
Cc1n[nH]c(Nc2ccccc2C(F)(F)F)c1C#N
Cc1nc(Nc2ccc3ccccc3c2)c2[nH]cnc2n1
Cc1nc(cn1-c1ccc(s1)C(=O)NC1CC1)-c1ccc(Cl)cc1
Cc1nc(cn1-c1ccc(s1)C(=O)NC1CC1)-c1ccc(F)cc1
Cc1nc(cn1-c1ccc(s1)C(=O)NC1CC1)-c1ccccc1
Cc1nc2c(C)cccc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2c(Cl)cc(F)cc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2c(OC(F)F)cccc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(-c2ccc(CN3CCCC(F)(F)C3)cc2)c(F)c1F)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(-c2ccc(CN3CCCC3)cc2)c(F)c1F)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(-c2ccc(CN3CCCCC3)cc2)c(F)c1F)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(-c2ccc(CN3CCS(=O)(=O)CC3)cc2)c(F)c1F)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(-c2cccc(CN3CCCCC3)c2)c(F)c1F)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(-c2cccc(CO)c2)c(F)c1F)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(c(F)c1F)-c1ccc(CN2CCOCC2)cc1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(c(F)c1F)-c1cccc(CNC2CC2)c1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(c(F)c1F)-c1ccccc1CN1CCCCC1)C(O)=O |(7.29,3.46,;5.75,3.46,;4.84,4.71,;3.38,4.23,;2.05,5,;.71,4.23,;.71,2.69,;2.05,1.93,;3.38,2.69,;4.84,2.22,;-.62,1.92,;-.62,.38,;.71,-.39,;-1.95,-.39,;-1.95,-1.93,;-3.29,.38,;-3.29,1.92,;-4.62,2.69,;-1.95,2.69,;-1.95,4.23,;-4.62,-.39,;-5.96,.38,;-7.29,-.39,;-7.29,-1.93,;-5.96,-2.7,;-4.62,-1.93,;-3.29,-2.69,;-3.29,-4.23,;-4.62,-5,;-4.62,-6.54,;-3.29,-7.31,;-1.95,-6.54,;-1.95,-5,;2.05,6.54,;3.38,7.31,;.71,7.31,)|
Cc1nc2c(cc(cc2[nH]1)-c1c(F)c(F)c(c(F)c1F)-n1c(C)ccc1C)C(O)=O |(7.17,1.28,;5.63,1.28,;4.73,2.53,;3.26,2.05,;1.93,2.82,;.6,2.05,;.6,.51,;1.93,-.26,;3.26,.51,;4.73,.04,;-.74,-.26,;-.74,-1.8,;.6,-2.57,;-2.07,-2.57,;-2.07,-4.11,;-3.4,-1.8,;-3.4,-.26,;-4.74,.51,;-2.07,.51,;-2.07,2.05,;-4.74,-2.57,;-6.14,-1.94,;-6.46,-.44,;-7.17,-3.09,;-6.4,-4.42,;-4.9,-4.1,;-3.75,-5.13,;1.93,4.36,;.6,5.13,;3.26,5.13,)|
Cc1nc2c(cc(cc2[nH]1)-c1ccc(OCc2ccccc2)cc1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1c(C)cccc1C)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1c(F)cccc1CN1CCCC1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1ccc(O)cc1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1cccc(C)c1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1cccc(CN2CCS(=O)(=O)CC2)c1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1cccc(CNC(C)(C)C)c1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1cccc(CO)c1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1cccc(F)c1F)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1cccc(O)c1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1cccc(OCc2ccccc2)c1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1ccccc1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1ccccc1CN1CCCC1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1ccccc1CN1CCCCC1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1ccccc1CN1CCOCC1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1ccccc1CN1CC[C@@H](F)C1)C(O)=O |r|
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1ccccc1F)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1ccccc1O)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-c1ccccc1OCc1ccccc1)C(O)=O
Cc1nc2c(cc(cc2[nH]1)-c1ccc(cc1)-n1c(C)ccc1C)C(O)=O
Cc1nc2c(cccc2n1-c1ccc(s1)C(=O)NC1CC1)C#N
Cc1nc2cc(C)ccc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2cc(Cl)ccc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2cc(F)c(F)cc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2cc(F)ccc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2cc(OC(F)(F)F)ccc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2cc(ccc2n1-c1ccc(s1)C(=O)NC1CC1)-c1ccccc1
Cc1nc2cc(ccc2n1-c1ccc(s1)C(=O)NC1CC1)C(F)(F)F
Cc1nc2cc3OCOc3cc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2cc3ccccc3cc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2ccc(OC(F)(F)F)cc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2ccc(cc2n1-c1ccc(s1)C(=O)NC1CC1)-c1ccccc1
Cc1nc2ccccc2n1-c1cc(cs1)C(=O)NC1CC1
Cc1nc2ccccc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2ccccc2n1-c1cscc1C(=O)NC1CC1 |(-4.07,-1.77,;-2.53,-1.77,;-1.62,-3.01,;-.16,-2.54,;1.18,-3.31,;2.51,-2.54,;2.51,-1,;1.18,-.23,;-.16,-1,;-1.62,-.52,;-2.39,.81,;-3.86,1.29,;-3.86,2.83,;-2.39,3.31,;-1.49,2.06,;0,1.66,;.4,.17,;1.09,2.75,;2.58,2.35,;3.67,1.26,;4.07,2.75,)|
Cc1nc2cccnc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2cnccc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2nc(C)cc(Nc3ccc(cc3)S(F)(F)(F)(F)F)n2n1
Cc1nc2ncccc2n1-c1ccc(s1)C(=O)NC1CC1
Cc1nc2ncnn2c(Nc2ccc3ccccc3c2)c1C
Cc1nccc(-c2ccc(cc2)-c2nc3ccncc3c(O)c2C#N)c1Cl
Cc1ncccc1-c1ccc(cc1)-c1cc(C(O)=O)c2ccccc2n1
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)OCCOCCOCCOc2ccc(c(F)c2)-c2ccc(cc2)-c2nc3ccc(F)cc3c(C(O)=O)c2C)C(C)(C)C)cc1 |r|
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)OCCOCCOCCOc2ccc(cc2)-c2ccc(cc2)-c2nc3ccc(F)cc3c(C(O)=O)c2C)C(C)(C)C)cc1 |r|
Cc1nn(C)c(C)c1-c1ccc(cc1)-c1nc2ccncc2c(O)c1C#N
Cc1nn(C)c(Nc2ccc(cc2)C(F)(F)F)c1C#N
Cc1nnc2c3ccccc3c(nn12)N1CCc2ccccc2C1
Cc1oncc1C(=O)Nc1ccc(cc1)C(F)(F)F
Cc1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1
Cc1oncc1C(=S)Nc1ccc(cc1)C#N
Cc1oncc1C(=S)Nc1ccc(cc1)C(F)(F)F
Cc1sc(N\N=C\c2ccccc2C(O)=O)nc1-c1ccccc1
Cc1sc(N\N=C\c2ccccc2C(O)=O)nc1-c1ccccc1Cl
ClC(Cl)(Cl)c1cccc(c1)C(=O)Nc1nc2ccccc2s1
Clc1c(CN2CCN(CC2)C(=O)C2CCCC2)cccc1Nc1nc2ccccc2s1
Clc1cc(ccn1)-n1nnc2c1C(=O)c1ccccc1C2=O
Clc1ccc(C(=O)Nc2nc3ccccc3s2)c(Cl)c1
Clc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
Clc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cn1
Clc1ccc(NC(=O)C(C#N)C(=O)C2CC2)nc1
Clc1ccc(NC(=O)Nc2cccc3cccnc23)cc1
Clc1ccc(NC(=O)c2ccc3ccccc3c2)c(Cl)c1
Clc1ccc(Oc2ccc(NC(=O)C(C#N)C(=O)C3CC3)cc2)cc1
Clc1ccc(\C=C/c2ccc(NC(=O)C(C#N)C(=O)C3CC3)cc2)cc1
Clc1ccc(\C=C\c2ccc(NC(=O)C(C#N)C(=O)C3CC3)cc2)cc1
Clc1ccc(cc1)-c1cc(C(=O)OCc2ccccc2)c2cc(Cl)c(Cl)cc2n1
Clc1ccc(cc1)-c1cc(COCc2ccccc2)c2cc(Cl)c(Cl)cc2n1
Clc1ccc(cc1)-n1nc(cc1C(=O)Nc1ccc(cc1)N1CCCCC1)C(=O)NCc1cccnc1
Clc1ccc(cc1)-n1nc(cc1C(=O)Nc1ccccc1)C(=O)NCc1ccccc1
Clc1ccc(cc1)-n1nc(cc1C(=O)Nc1ccccc1)C(=O)NCc1cccnc1
Clc1ccc(cc1)C#Cc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
Clc1ccc(cc1)C(=O)NCC(=O)N[C@@H]1CCCc2ccccc12 |r|
Clc1ccc(cc1)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
Clc1ccc(cc1)C(=O)NCCCC(=O)N[C@@H]1CCCc2ccccc12 |r|
Clc1ccc(cc1)C(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
Clc1ccc(cc1)C1CCC(CC1)C1C(=O)C(=O)c2ccccc2C1=O |(22.89,-15.28,;24.23,-14.51,;25.56,-15.28,;26.9,-14.51,;26.9,-12.97,;25.56,-12.2,;24.23,-12.97,;28.23,-12.2,;29.56,-12.97,;30.9,-12.2,;30.9,-10.66,;29.56,-9.89,;28.23,-10.66,;32.23,-9.89,;32.23,-8.35,;30.9,-7.58,;33.56,-7.58,;33.56,-6.04,;34.9,-8.35,;36.27,-7.53,;37.67,-8.32,;37.67,-9.92,;36.27,-10.71,;34.9,-9.89,;33.56,-10.66,;33.56,-12.2,)|
Clc1ccc(cc1)[C@H]1CC[C@@H](CC1)C1C(=O)C(=O)c2ccccc2C1=O |r,wU:7.7,wD:10.14,(15.73,-5.45,;14.39,-6.22,;14.39,-7.76,;13.06,-8.53,;11.71,-7.75,;11.71,-6.23,;13.05,-5.45,;10.38,-8.52,;10.38,-10.06,;9.05,-10.83,;7.71,-10.05,;7.71,-8.53,;9.04,-7.76,;6.35,-10.84,;6.35,-12.37,;7.7,-13.16,;5.03,-13.14,;5.03,-14.7,;3.67,-12.36,;2.35,-13.13,;1.02,-12.36,;1.02,-10.81,;2.29,-10.08,;3.66,-10.88,;5.05,-10.07,;5.05,-8.52,)|
Clc1ccc(cc1Cl)C(=O)NCC(=O)N[C@@H]1CCCc2ccccc12
Clc1ccc(cc1Cl)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
Clc1ccc(cc1Cl)C(=O)NCCCC(=O)N[C@@H]1CCCc2ccccc12
Clc1ccc(cn1)-n1nnc2c1C(=O)c1ccccc1C2=O
Clc1ccc2[nH]c3[C@@H](CCCc3c2c1)NC(=O)c1ccccn1 |r|
Clc1ccc2n(cnc2c1)-c1ccc(s1)C(=O)NC1CC1
Clc1cccc(NC(=O)C(C#N)C(=O)C2CC2)c1
Clc1cccc(c1)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
Clc1ccccc1-c1csc(N\N=C\c2ccccc2C(=O)OC2CCCCC2)n1
Clc1ccccc1-c1csc(N\N=C\c2ccccc2C(=O)OCCc2ccccc2)n1
Clc1ccccc1-c1csc(N\N=C\c2ccccc2C(=O)OCc2ccccc2)n1
Clc1ccccc1NC(=O)C(C#N)C(=O)C1CC1
Cn1c(nc2cccc(C(O)=O)c12)-c1ccc(cc1)-c1ccccc1
Cn1c(nc2ccccc12)-c1ccc(s1)-c1nc2ccccc2n1C
Cn1c(nc2ccccc12)-c1ccc(s1)C(=O)NC1CC1
Cn1cc(C(=O)NCC(c2ccccc2)c2ccccc2)c(O)n1
Cn1cc(cn1)-c1ccc(cc1)-c1nc2ccncc2c(O)c1C#N
Cn1ccc2c(C(=O)OC22CCCCC2)c1=O
Cn1cnc2c(cc(nc12)-c1ccc(cc1)-c1ccccc1)C(O)=O
Cn1n2ccccc2c(C(=O)Nc2c(F)c(F)c(c(F)c2F)-c2ccccc2)c1=O
Cn1nc(O)c(C(N)=O)c1COc1ccccc1
Cn1nc(O)c(C(O)=O)c1CNc1ccccc1
Cn1nc(O)c(C(O)=O)c1COc1ccc(cc1)C(F)(F)F
Cn1nc(O)c(C(O)=O)c1COc1cccc(c1)C(F)(F)F
Cn1nc(O)c(C(O)=O)c1COc1ccccc1
Cn1nc(O)c(C(O)=O)c1CSc1ccccc1
Cn1nc(O)c(n1)C(=O)Nc1c(F)c(F)c(-c2ccccc2)c(F)c1F
Cn1nc(OCC2CC2)c(C(O)=O)c1COc1ccccc1
Cn1nc(OCc2ccccc2)c(C(O)=O)c1COc1ccccc1
Cn1nc2cc(cc(C(O)=O)c2n1)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F
Cn1nc2cc(cc(C(O)=O)c2n1)-c1c(F)c(F)c(c(F)c1F)-c1cccc(CN2CCCCC2)c1
Cn1nc2cc(cc(C(O)=O)c2n1)-c1c(F)c(F)c(c(F)c1F)-c1cccc(CN2CCOCC2)c1
Cn1nc2cc(cc(C(O)=O)c2n1)-c1ccc(cc1)-c1cccc(CN2CCOCC2)c1
Cn1nc2cc(cc(C(O)=O)c2n1)-c1ccc(cc1)-c1ccccc1
Cn1nc2cc(cc(C(O)=O)c2n1)-c1ccc(cc1)-c1ccccc1CN1CCOCC1
Cn1nnc2c(cc(cc12)-c1ccc(cc1)-c1cccc(CN2CCCCC2)c1)C(O)=O
Cn1nnc2cc(cc(C(O)=O)c12)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F
Cn1nnc2cc(cc(C(O)=O)c12)-c1c(F)c(F)c(c(F)c1F)-c1cccc(CN2CCCCC2)c1
Cn1nnc2cc(cc(C(O)=O)c12)-c1c(F)c(F)c(c(F)c1F)-c1cccc(CN2CCOCC2)c1
Cn1nnc2cc(cc(C(O)=O)c12)-c1ccc(cc1)-c1ccc(CN2CCOCC2)cc1
Cn1nnc2cc(cc(C(O)=O)c12)-c1ccc(cc1)-c1cccc(CN2CCCC2)c1
Cn1nnc2cc(cc(C(O)=O)c12)-c1ccc(cc1)-c1cccc(CN2CCOCC2)c1
Cn1nnc2cc(cc(C(O)=O)c12)-c1ccc(cc1)-c1ccccc1
Cn1nnc2cc(cc(C(O)=O)c12)-c1ccc(cc1)-c1ccccc1CN1CCCC1
Cn1nnc2cc(cc(C(O)=O)c12)-c1ccc(cc1)-c1ccccc1CN1CCOCC1
FC(F)(F)Oc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
FC(F)(F)Oc1ccc(NC(=S)c2cnoc2C2CC2)cc1
FC(F)(F)Oc1ccc(NC(=S)c2cnoc2C2CCCCC2)cc1
FC(F)(F)Oc1ccc(cc1)C(=O)NCC(=O)N[C@@H]1CCCc2ccccc12 |r|
FC(F)(F)Oc1ccc(cc1)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
FC(F)(F)Oc1ccc(cc1)C(=O)NCCCC(=O)N[C@@H]1CCCc2ccccc12 |r|
FC(F)(F)S(=O)(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
FC(F)(F)S(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
FC(F)(F)Sc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
FC(F)(F)c1cc(Nc2ccc3ccccc3c2)n2ncnc2n1
FC(F)(F)c1cc(cc(c1)C(F)(F)F)-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
FC(F)(F)c1ccc(Cc2c[nH]c(C(=O)NC3CC3)c2C#N)cn1
FC(F)(F)c1ccc(Cc2c[nH]c(c2)C(=O)NC2CC2)cn1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)C#C)cc1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)nc1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)C2CCC2)cc1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)C2CCCC2)cc1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)C2CCCN2)cc1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)C2CCCO2)cc1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)C2CCOC2)cc1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)C=C)cc1
FC(F)(F)c1ccc(NC(=O)C(C#N)C(=O)c2ccc(cc2)C(F)(F)F)cc1
FC(F)(F)c1ccc(NC(=O)C(N=O)C#N)cc1
FC(F)(F)c1ccc(NC(=O)C(\C#N)=C2/CCCCO2)cc1
FC(F)(F)c1ccc(NC(=O)C(\C#N)=C2/CCOC2)cc1
FC(F)(F)c1ccc(NC(=O)C(\C#N)=C2\CCCCO2)cc1
FC(F)(F)c1ccc(NC(=O)C(\C#N)=C2\CCCO2)cc1
FC(F)(F)c1ccc(NC(=O)c2no[nH]c2=O)cc1
FC(F)(F)c1ccc(NC(=S)c2cnoc2C2CC2)cc1
FC(F)(F)c1ccc(NC(=S)c2cnoc2C2CCCCC2)cc1
FC(F)(F)c1ccc(Nc2[nH][nH]c(=O)c2C#N)cc1
FC(F)(F)c1ccc(Nc2[nH]nc(-c3ccco3)c2C#N)cc1
FC(F)(F)c1ccc(Nc2[nH]nc(-c3cccs3)c2C#N)cc1
FC(F)(F)c1ccc(Nc2[nH]nc(C3CCCC3)c2C#N)cc1
FC(F)(F)c1ccc(Nc2[nH]nc(c2C#N)-c2ccccc2)cc1
FC(F)(F)c1ccc(Nc2[nH]nc(c2C#N)-c2cccnc2)cc1
FC(F)(F)c1ccc(Nc2[nH]nc(c2C#N)-c2ccncc2)cc1
FC(F)(F)c1ccc(Nc2[nH]nc3CCCC(=O)c23)cc1
FC(F)(F)c1ccc(Nc2[nH]nc3CCCCc23)cc1
FC(F)(F)c1ccc(Nc2cc(Cl)nc3ncnn23)cc1
FC(F)(F)c1ccc(Nc2cc(nc3ncnn23)C(F)(F)F)cc1
FC(F)(F)c1ccc(Oc2ccc(NC(=O)C(C#N)C(=O)C3CC3)cc2)cc1
FC(F)(F)c1ccc(cc1)-c1ccc(NC(=O)c2no[nH]c2=O)cc1
FC(F)(F)c1ccc(cc1)C(=O)NCC(=O)N[C@@H]1CCCc2ccccc12 |r|
FC(F)(F)c1ccc(cc1)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
FC(F)(F)c1ccc(cc1)C(=O)NCCCC(=O)N[C@@H]1CCCc2ccccc12 |r|
FC(F)(F)c1ccc2n(cnc2c1)-c1ccc(s1)C(=O)NC1CC1
FC(F)(F)c1cccc(NC(=O)C(C#N)C(=O)C2CC2)c1
FC(F)(F)c1cccc(c1)-c1ccc(NC(=O)c2no[nH]c2=O)cc1
FC(F)(F)c1ccccc1-n1nnc2c1C(=O)c1ccccc1C2=O
FC(F)(F)c1ccccc1NC(=O)C(C#N)C(=O)C1CC1
FC(F)(F)c1ccccc1NC(=O)Nc1cccc2ccccc12
FC(F)(F)c1csc(n1)-c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
FC(F)(F)c1nc2ccccc2n1-c1ccc(s1)C(=O)NC1CC1
FC1(F)Oc2ccc(cc2O1)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
Fc1c(F)c(-c2ccc(cc2)C(F)(F)F)c(F)c(F)c1NC(=O)c1no[nH]c1=O
Fc1c(F)c(-c2cccc(OC(F)(F)F)c2)c(F)c(F)c1NC(=O)c1no[nH]c1=O
Fc1c(F)c(-c2cccc(c2)C(F)(F)F)c(F)c(F)c1NC(=O)c1no[nH]c1=O
Fc1c(F)c(-c2ccccc2)c(F)c(F)c1NC(=O)c1no[nH]c1=O
Fc1cc(Cl)c2ncn(-c3ccc(s3)C(=O)NC3CC3)c2c1
Fc1cc(I)ccc1Nc1ccnc2cc(Cl)ccc12
Fc1cc(cc(F)c1NC(=O)c1no[nH]c1=O)-c1ccc(cc1)C(F)(F)F
Fc1cc(cc(F)c1NC(=O)c1no[nH]c1=O)-c1cccc(c1)C(F)(F)F
Fc1cc(cc(F)c1NC(=O)c1no[nH]c1=O)-c1ccccc1
Fc1ccc(\C=C\C(=O)Nc2ccccn2)cc1
Fc1ccc(c(F)c1)-n1ncc2C(CCCc12)NC(=O)c1onc2CCCCc12
Fc1ccc(cc1)-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O
Fc1ccc(cc1)-c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
Fc1ccc(cc1)-n1c(=O)sn(-c2ccccc2)c1=O
Fc1ccc(cc1)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
Fc1ccc2C(=O)c3c(nnn3-c3cc(F)c(c(F)c3)-c3ccccc3F)C(=O)c2c1 |(43.18,-38.37,;44.51,-39.14,;44.51,-40.68,;45.84,-41.45,;47.17,-40.69,;48.5,-41.46,;48.5,-43,;49.85,-40.69,;49.85,-39.14,;51.33,-38.67,;52.24,-39.92,;51.32,-41.17,;51.79,-42.64,;50.75,-43.78,;51.22,-45.24,;50.19,-46.38,;52.72,-45.57,;53.76,-44.42,;55.26,-44.74,;53.29,-42.96,;53.2,-47.03,;52.16,-48.17,;52.63,-49.63,;54.14,-49.96,;55.17,-48.81,;54.7,-47.35,;55.72,-46.2,;48.51,-38.36,;48.51,-36.82,;47.17,-39.14,;45.84,-38.37,)|
Fc1ccc2C(=O)c3nnn(c3C(=O)c2c1)-c1cc(F)c(c(F)c1)-c1ccccc1F |(57.14,-41.19,;58.47,-40.42,;58.47,-38.88,;59.8,-38.11,;61.13,-38.87,;62.47,-38.09,;62.47,-36.56,;63.82,-38.88,;65.29,-38.4,;66.2,-39.66,;65.28,-40.91,;63.81,-40.43,;62.47,-41.2,;62.47,-42.74,;61.13,-40.43,;59.8,-41.19,;65.75,-42.38,;64.72,-43.51,;65.18,-44.98,;64.15,-46.12,;66.69,-45.31,;67.73,-44.16,;69.23,-44.48,;67.25,-42.7,;67.16,-46.77,;66.13,-47.91,;66.6,-49.37,;68.1,-49.69,;69.14,-48.54,;68.66,-47.09,;69.69,-45.94,)|
Fc1ccc2n(cnc2c1)-c1ccc(s1)C(=O)NC1CC1
Fc1cccc(c1)-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O
Fc1cccc(c1)-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
Fc1cccc2n(cnc12)-c1ccc(s1)C(=O)NC1CC1
Fc1ccccc1-c1c(F)cc(cc1F)-n1cc(nn1)-c1ccccc1 |(16.24,-29.67,;15.2,-30.81,;15.68,-32.27,;14.65,-33.42,;13.14,-33.1,;12.67,-31.63,;13.71,-30.49,;13.23,-29.03,;11.73,-28.7,;10.69,-29.84,;11.26,-27.23,;12.3,-26.09,;13.79,-26.42,;14.27,-27.88,;15.78,-28.2,;11.83,-24.63,;10.35,-24.14,;10.36,-22.59,;11.84,-22.12,;12.74,-23.38,;9.12,-21.69,;9.29,-20.15,;8.05,-19.24,;6.64,-19.86,;6.47,-21.4,;7.71,-22.31,)|
Fc1ccccc1-c1c(F)cc(cc1F)-n1cc(nn1)C(=O)c1ccccc1 |(65.68,-13.41,;64.65,-14.55,;65.12,-16.01,;64.09,-17.16,;62.58,-16.84,;62.11,-15.37,;63.15,-14.23,;62.67,-12.77,;61.17,-12.44,;60.13,-13.58,;60.7,-10.98,;61.74,-9.84,;63.24,-10.16,;63.71,-11.62,;65.22,-11.94,;61.27,-8.37,;59.79,-7.89,;59.8,-6.34,;61.28,-5.86,;62.18,-7.12,;58.56,-5.43,;58.72,-3.89,;57.15,-6.05,;55.91,-5.13,;54.5,-5.75,;54.33,-7.29,;55.58,-8.2,;56.99,-7.57,)|
Fc1ccccc1-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O |(24.4,-30.16,;25.9,-30.49,;26.37,-31.95,;27.88,-32.27,;28.91,-31.12,;28.44,-29.67,;26.94,-29.35,;26.47,-27.89,;24.96,-27.56,;23.93,-28.7,;24.49,-26.09,;25.53,-24.96,;27.03,-25.28,;27.5,-26.74,;29.01,-27.06,;25.06,-23.49,;25.98,-22.24,;25.07,-20.98,;23.59,-21.46,;23.59,-23.01,;22.24,-23.78,;22.24,-25.32,;20.91,-23.01,;19.58,-23.77,;18.25,-23,;18.25,-21.46,;19.58,-20.69,;20.91,-21.45,;22.25,-20.67,;22.25,-19.14,)|
Fc1ccccc1-c1c(F)cc(cc1F)-n1nnc2c1CCCC2=O |(27.14,-13.27,;26.11,-14.41,;26.58,-15.87,;25.55,-17.02,;24.04,-16.69,;23.57,-15.23,;24.61,-14.09,;24.14,-12.63,;22.63,-12.3,;21.6,-13.44,;22.16,-10.84,;23.2,-9.7,;24.7,-10.02,;25.17,-11.48,;26.68,-11.8,;22.73,-8.24,;23.65,-6.99,;22.74,-5.73,;21.27,-6.2,;21.26,-7.75,;19.92,-8.53,;18.58,-7.75,;18.58,-6.2,;19.92,-5.42,;19.92,-3.88,)|
Fc1ccccc1-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
Fc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1ccccc1
Fc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1ccccn1
Fc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1cscn1
Fc1ccccc1-n1ncc2C(CCCc12)NC(=O)c1onc2CCCCc12
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(Br)ccn1 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(Cl)ccn1 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc(ccn1)C(F)(F)F |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1cc2ccccc2[nH]1 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ccc(cn1)C(F)(F)F |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ccccn1 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1nc2ccccc2o1 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ncc2ccccn12 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ncccn1 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1ncn2CCCCc12 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2ccccc12 |r|
Fc1ccccc1-n1ncc2[C@@H](CCCc12)NC(=O)c1onc2CCCCc12 |r|
Fc1ccccc1-n1ncc2[C@H](CCCc12)NC(=O)c1ccccn1 |r|
Fc1ccccc1-n1ncc2[C@H](CCCc12)NC(=O)c1noc2CCCCc12 |r|
Fc1ccccc1-n1ncc2[C@H](CCCc12)NC(=O)c1onc2CCCCc12 |r|
Fc1ccccc1NC(=O)c1ccc2ccccc2c1
Fc1ccnc(c1)C(=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F |r|
Ic1cccc(c1)-n1nnc2c1C(=O)c1ccccc1C2=O
N1c2ccccc2Oc2nc3ccccc3nc12
NC(=O)c1cc(F)c(F)cc1-n1cc(COc2ccc(cc2)C(F)(F)F)nn1
NC(=O)c1cc(F)cc2[nH]c(nc12)-c1ccc(cc1F)-c1ccc(NC(=O)C2CC2)cc1F
NC(=O)c1cc(F)cc2[nH]c(nc12)-c1ccc(cc1F)-c1cccc(NC(=O)C2CC2)c1
NC(=O)c1cc(cc(c1)-c1ccc(cc1)-c1ccc(cc1)C(F)(F)F)C(O)=O
NC(=O)c1cc(cc(c1)-c1ccc(cc1)-c1ccccc1)C(O)=O
NC(=O)c1cc(cc(c1)-c1cccc(c1)-c1ccc(cc1)C(F)(F)F)C(O)=O
NC(=O)c1cc(cc(c1)-c1cccc(c1)-c1ccccc1)C(O)=O
NC(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
NC(=O)c1ccc(NC(=O)c2cc(nn2-c2ccc(Cl)cc2)C(=O)NCc2ccccc2)cc1
NC(=O)c1ccc(s1)-n1cnc2ccccc12
NC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1ccc(N)nc1
NC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1ccc(OCCN2CCCCC2)cc1
NC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1ccc(cc1)C(=O)N1CCCC1
NC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1ccccc1
NC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1ccccn1
NC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1cccnc1
NC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1cncc(CN2CCCC2)c1
NC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1cncc(c1)C(=O)N1CCCC1
NCCO.CC(=O)Nc1cccc2ccc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)cc12
NCCO.CC(C)(C)OC(=O)N1CCc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12
NCCO.CC(C)(C)OC(=O)NCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.CC(C)(C)c1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1
NCCO.CCNC(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.CCc1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1
NCCO.CN(C)C(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.CN(C)C(=O)c1cccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12
NCCO.CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.CNC(=O)c1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1
NCCO.CNC(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.CNC(=O)c1cccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1
NCCO.CNC(=O)c1cccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12
NCCO.COC(=O)c1ccc(CCCCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1
NCCO.COC(=O)c1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1
NCCO.COC(=O)c1ccc(cc1)-n1cc(nn1)-c1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.COC(=O)c1ccc2cc(CCCCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.COC(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.COC(=O)c1cccc(CCCCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1
NCCO.COC(=O)c1cccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1
NCCO.COC(=O)c1cccc2cc(CCCCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12
NCCO.COC(=O)c1cccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12
NCCO.COC(=O)c1ccccc1-n1cc(nn1)-c1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.COC(=O)c1ccccc1CCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.COC(=O)c1ccccc1CCc1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.COCOc1cc2ccccc2cc1CCc1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.COCOc1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.COCOc1ccc2ccc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)cc2c1
NCCO.COc1cc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc(OC)c1
NCCO.COc1cc2ccccc2cc1CCc1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.COc1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1
NCCO.COc1ccc2c(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)cccc2c1
NCCO.COc1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)c(OC)cc2c1
NCCO.COc1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.COc1ccc2ccc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)cc2c1
NCCO.COc1ccc2cccc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)c2c1
NCCO.COc1cccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1
NCCO.COc1cccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12
NCCO.COc1cccc2ccc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)cc12
NCCO.COc1ccccc1CCc1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.Cc1cc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)ccc1F
NCCO.Cc1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1
NCCO.NC(=O)c1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1
NCCO.NC(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.NC(=O)c1cccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1
NCCO.NCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.NCCO.OC(=O)c1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1
NCCO.NCCO.OC(=O)c1ccc2cc(CCCCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.NCCO.OC(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.NCCO.OC(=O)c1cccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1
NCCO.NCCO.OC(=O)c1cccc2cc(CCCCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12
NCCO.NCCO.OC(=O)c1cccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12
NCCO.NCCO.OC(=O)c1ccccc1CCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCCNC(=O)c1ccc2ccccc2c1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCCNC(=O)c1cccc2ccccc12
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCCNC(=O)c1ccccc1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cc(cc(c1)C(F)(F)F)C(F)(F)F
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cc2ccccc2c2ccccc12
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(CC#N)cc1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(F)c(F)c1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(OC(F)(F)F)cc1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(Oc2ccccc2)cc1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(cc1)-c1ccccc1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(cc1)C(F)(F)F
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc2cccc(NC(=O)c3ccccc3)c2c1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc2ccccc2c1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cccc(Cl)c1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cccc(c1)C(F)(F)F
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cccc2ccccc12
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccccc1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccccc1C(F)(F)F
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cnc2ccccc2c1
NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1nccc2ccccc12
NCCO.OCCNC(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1
NCCO.OCc1ccccc1CCc1c([nH]c(=O)[nH]c1=O)C(O)=O
Nc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1
Nc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
Nc1ccc(cc1)-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
Nc1cccc(c1)-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
Nc1cccc(c1)-n1nnc2c1C(=O)c1ccccc1C2=O
Nc1ccccc1-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
Nc1n[nH]c(Nc2ccc(cc2)C(F)(F)F)c1C#N
Nc1nc2cc3ccccc3c2c(Nc2ccc(Cl)cc2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2ccc(Cl)cc2F)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2cccc(Br)c2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2cccc(F)c2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2ccccc2)[nH]1
Nc1nnc(s1)-c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1ccccc1
O=C(CCNC(=O)c1ccc(cc1)C#N)N[C@@H]1CCCc2ccccc12
O=C(CCNC(=O)c1ccccc1)N[C@@H]1CCCc2ccccc12 |r|
O=C(N1CCC1)c1ccc(s1)-n1cnc2ccccc12
O=C(N1CCCC1)c1ccc(s1)-n1cnc2ccccc12
O=C(N1CCCCC1)c1ccc(s1)-n1cnc2ccccc12
O=C(NC1CC1)c1ccc(s1)-c1nc2ccccc2o1
O=C(NC1CC1)c1ccc(s1)-n1c2ccccc2[nH]c1=O
O=C(NC1CC1)c1ccc(s1)-n1cnc2ccccc12
O=C(NC1CC1)c1ccc(s1)-n1ncc2ccccc12
O=C(NC1CC1)c1ccc(s1)-n1nnc2ccccc12
O=C(NC1CC1)c1ccc(s1)N1CCSc2ccccc12
O=C(NC1CCC1)c1ccc(s1)-n1cnc2ccccc12
O=C(NC1CCCC1)c1ccc(s1)-n1cnc2ccccc12
O=C(NC1CCCc2c1cnn2-c1ccccc1)c1ccccn1
O=C(NC1CCCc2c1cnn2-c1ccccc1)c1noc2CCCCc12
O=C(NC1CCCc2c1cnn2-c1ccccc1)c1onc2CCCCc12
O=C(N[C@@H]1CCCc2c1cnn2-c1cccc(c1)C(=O)N1CCOCC1)c1noc2CCCCc12 |r|
O=C(Nc1ccc(CC#N)cc1)C(C#N)C(=O)C1CC1
O=C(Nc1ccc(CCc2ccccc2)cc1)C(C#N)C(=O)C1CC1
O=C(Nc1ccc(Oc2ccccc2)cc1)C(C#N)C(=O)C1CC1
O=C(Nc1ccc(cc1)-c1ccccc1)C(C#N)C(=O)C1CC1
O=C(Nc1ccc(cc1)-c1ccccc1)c1no[nH]c1=O
O=C(Nc1ccc(cc1)-c1ccco1)C(C#N)C(=O)C1CC1
O=C(Nc1ccc(cc1)-c1cccs1)C(C#N)C(=O)C1CC1
O=C(Nc1ccc(cc1)-c1ncco1)C(C#N)C(=O)C1CC1
O=C(Nc1ccc(cc1)C#N)C(C#N)C(=O)C1CC1
O=C(Nc1ccccc1)C(C#N)C(=O)C1CC1
O=C(Nc1ccccc1-c1ccccc1)c1no[nH]c1=O
O=C(Nc1ccncc1)C(C#N)C(=O)C1CC1
O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1
O=C1C=CC(=O)C=C1 |c:2,6|
O=C1N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]12 |r|
O=C1OC2(CCCC2)c2ccn(C3CC3)c(=O)c12
O=C1OC2(CCCCC2)c2ccn(C3CC3)c(=O)c12
O=C1OC2(CCCCC2)c2ccn(C3CCC3)c(=O)c12
O=C1OC2(CCCCC2)c2ccn(C3CCCC3)c(=O)c12
O=C1OC2(CCCCC2)c2ccn(C3CCCCC3)c(=O)c12
O=C1OC2(CCCCC2)c2ccn(CC3CC3)c(=O)c12
O=C1c2nnn(-c3nc4ccccc4[nH]3)c2C(=O)c2ccccc12
O=C1c2nnn(c2C(=O)c2ccccc12)-c1ccc(cc1)-c1ccccc1
O=C1c2nnn(c2C(=O)c2ccccc12)-c1ccc(cc1)-c1cccnc1
O=C1c2nnn(c2C(=O)c2ccccc12)-c1ccc(cc1)-c1ccncc1
O=C1c2nnn(c2C(=O)c2ccccc12)-c1ccc(cc1)-c1cncnc1
O=C1c2nnn(c2C(=O)c2ccccc12)-c1ccc(nc1)N1CCOCC1
O=C1c2nnn(c2C(=O)c2ccccc12)-c1ccc2OCOc2c1
O=C1c2nnn(c2C(=O)c2ccccc12)-c1ccc2ccccc2c1
O=C1c2nnn(c2C(=O)c2ccccc12)-c1cccc(c1)C#N
O=C1c2nnn(c2C(=O)c2ccccc12)-c1ccccc1C#N
O=C1c2nnn(c2C(=O)c2ccccc12)-c1ccncc1
O=Cc1ccccc1CN=Nc1nc(cs1)-c1ccccc1 |w:10.11|
O=c1cc(oc2ccccc12)-c1ccccc1
OC(=O)C1=C(CCC1)C(=O)Nc1c(F)c(F)c(c(F)c1F)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1c(F)cc(cc1F)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1c(F)cc(cc1F)-c1ccccc1Cl |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1c(F)cc(cc1F)-c1ccccc1F |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1cc(Br)c(OCc2c(F)cccc2Cl)c(Br)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1cc(Br)c(OCc2ccccc2)c(Br)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(OCc2c(F)cccc2Cl)c(Cl)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(OCc2ccccc2)cc1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(c(Cl)c1)-c1ccc(Br)cc1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(c(Cl)c1)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1)-c1ccccc1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1C#N)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1C(F)(F)F)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1C(F)(F)F)-c1cccc2ccccc12 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1Cl)-c1ccc(Br)cc1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1Cl)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1F)-c1ccc(Br)cc1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1F)-c1ccc(OC(F)(F)F)cc1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1F)-c1cccc(O)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1F)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1[N+]([O-])=O)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(COC1)C(=O)Nc1c(F)c(F)c(c(F)c1F)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(COC1)C(=O)Nc1c(F)cc(cc1F)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(COC1)C(=O)Nc1ccc(OCc2c(F)cccc2Cl)c(Cl)c1 |t:3|
OC(=O)C1=C(CS(=O)(=O)C1)C(=O)Nc1ccc(cc1)-c1ccccc1 |t:3|
OC(=O)C1=C(CSC1)C(=O)Nc1c(F)c(F)c(c(F)c1F)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(CSC1)C(=O)Nc1c(F)cc(cc1F)-c1cccc(OC(F)(F)F)c1 |t:3|
OC(=O)C1=C(CSC1)C(=O)Nc1cc(Br)c(OCc2c(F)cccc2Cl)c(Br)c1 |t:3|
OC(=O)C1=C(CSC1)C(=O)Nc1cc(Br)c(OCc2ccccc2)c(Br)c1 |t:3|
OC(=O)C1=C(CSC1)C(=O)Nc1ccc(cc1)-c1ccccc1 |t:3|
OC(=O)c1c(F)cccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
OC(=O)c1c(O)c(nc2c(Br)cccc12)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2c(Cl)cccc12)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2c(OC(F)(F)F)cccc12)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2c(cccc12)-c1ccccc1)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2c(cccc12)C(F)(F)F)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2ccc(Br)cc12)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2ccc(F)cc12)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2ccc(F)cc12)-c1ccc(O)cc1
OC(=O)c1c(O)c(nc2ccc(F)cc12)-c1ccc(Oc2ccccc2)cc1
OC(=O)c1c(O)c(nc2ccc(F)cc12)-c1ccc(Sc2ccccc2)cc1
OC(=O)c1c(O)c(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccc(O)cc1
OC(=O)c1c(O)c(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1c(O)c(nc2ccc(OC(F)(F)F)cc12)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2ccc(cc12)-c1ccccc1)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2ccc(cc12)-c1ccsc1)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2ccc(cc12)C(F)(F)F)-c1ccc(Cl)cc1
OC(=O)c1c(O)c(nc2ccccc12)-c1ccc(Oc2ccccc2)cc1
OC(=O)c1c(O)c(nc2ccccc12)-c1ccc(cc1)-c1ccc(O)cc1
OC(=O)c1c(O)c(nc2ccccc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1c(O)c(nc2ccccc12)-c1ccccc1
OC(=O)c1c(O)csc1Nc1ccc2ccccc2c1
OC(=O)c1c2CCc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1
OC(=O)c1cc(Br)cc2[nH]c(nc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1cc(Cl)cc2CC(=Nc12)c1ccc(cc1)-c1ccccc1 |c:10|
OC(=O)c1cc(Cl)cc2[nH]c(nc12)-c1ccc(cc1)-c1ccccc1F
OC(=O)c1cc(Cl)cc2[nH]c(nc12)-c1ccc(cc1F)-c1ccccc1
OC(=O)c1cc(Cl)cc2nc([nH]c12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1cc(Cl)ccc1Nc1ccc(nc1)-c1ccccc1Cl
OC(=O)c1cc(Cl)cnc1Nc1c(F)cc(cc1F)-c1ccccc1
OC(=O)c1cc(F)cc2[nH]c([nH]c12)-c1ccc(cc1F)-c1ccccc1
OC(=O)c1cc(F)cc2[nH]c(nc12)-c1c(F)cc(cc1F)-c1ccccc1
OC(=O)c1cc(F)cc2[nH]c(nc12)-c1ccc(cc1)-c1cccnc1
OC(=O)c1cc(F)cc2[nH]c(nc12)-c1ccc(cc1F)-c1ccc(NC(=O)C2CC2)cc1F
OC(=O)c1cc(\C=C\C(=O)c2ccc(Cl)cc2)ccc1O
OC(=O)c1cc(ccc1Nc1ccc(nc1)-c1ccccc1Cl)C1CC1
OC(=O)c1cc(ccc1Nc1ccc(nc1)-c1ccccc1F)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(-c2ccccc2)c(c1)-c1ccccc1)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(-c2ccccc2)c(c1)C(F)(F)F)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(C2CC2)c(c1)-c1ccccc1)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(nc1)-c1c(F)cc(O)cc1F)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(nc1)-c1cc(F)ccc1F)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(nc1)-c1cc(ccc1F)C(F)(F)F)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(nc1)-c1cccc(OC2CC2)c1)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(nc1)-c1ccccc1)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(nc1)-c1ccccc1C(F)(F)F)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(nc1)-c1ccccc1C1CC1)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(nc1)-c1ccccc1Cl)C1CC1
OC(=O)c1cc(ccc1Nc1cnc(nc1)-c1ccccc1F)C1CC1
OC(=O)c1cc(ccc1Nc1cncc(c1)-c1ccccc1)C1CC1
OC(=O)c1cc(cnc1Nc1c(F)cc(cc1F)-c1cccc(OC(F)(F)F)c1)C1CC1
OC(=O)c1cc(cnc1Nc1c(F)cc(cc1F)-c1cccc(OC2CC2)c1)C1CC1
OC(=O)c1cc(cnc1Nc1c(F)cc(cc1F)-c1ccccc1Cl)C1CC1
OC(=O)c1cc(cnc1Nc1ccc2n(ccc2c1)-c1ccccc1)C1CC1
OC(=O)c1cc(nc2ccc(Cl)cc12)-c1ccc(F)cc1
OC(=O)c1cc(nc2ccc(Cl)cc12)-c1ccc(OC(F)(F)F)cc1
OC(=O)c1cc(nc2ccc(Cl)cc12)-c1ccc(Oc2ccccc2)cc1
OC(=O)c1cc(nc2ccc(F)cc12)-c1ccc(Oc2ccccc2)cc1
OC(=O)c1cc(nc2ccc(F)cc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1ccc(F)nc1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1ccccn1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1cccnc1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1cccnc1C(F)(F)F
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1cccnc1Cl
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1cccnc1F
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1cccnn1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1ccncc1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1cnccc1C(F)(F)F
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1cncnc1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1ncccn1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-n1ccnc1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)C1CCCCC1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)N1CCCCC1
OC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)N1CCOCC1
OC(=O)c1cc(nc2ccccc12)-c1ccccc1
OC(=O)c1cc(nc2ocnc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1cc(nc2sccc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1ccc(Cl)cc1Nc1ccccc1
OC(=O)c1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
OC(=O)c1ccc(\C=N\c2cccc3ccccc23)cc1
OC(=O)c1ccc(cc1)-c1ccc2nc(c(O)c(C(O)=O)c2c1)-c1ccc(Cl)cc1
OC(=O)c1cccc(c1)-c1ccc(C=c2c(=C)[nH]n(-c3ccccc3)c2=O)o1 |w:13.13|
OC(=O)c1cccc(c1)-n1ncc2[C@@H](CCCc12)NC(=O)c1noc2CCCCc12 |r|
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(-c2cc(F)cc(F)c2)c(F)c1F
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(-c2ccc(F)c(F)c2)c(F)c1F
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(-c2ccc(F)cc2)c(F)c1F
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(-c2ccc(OCc3ccccc3)cc2)c(F)c1F
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(-c2cccc(OC(F)(F)F)c2)c(F)c1F
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(-c2ccccc2)c(F)c1F
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(-c2cccnc2)c(F)c1F
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(-c2ccsc2)c(F)c1F
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(c(F)c1F)-c1cccc(F)c1F |(-7.14,3.26,;-5.8,2.49,;-4.47,3.26,;-5.8,.95,;-7.14,.18,;-7.14,-1.36,;-5.8,-2.13,;-4.47,-1.36,;-3.01,-1.84,;-2.1,-.59,;-3.01,.65,;-4.47,.18,;-.56,-.59,;.21,.74,;-.56,2.08,;1.75,.74,;2.52,2.08,;2.52,-.59,;1.75,-1.92,;2.52,-3.26,;.21,-1.92,;-.56,-3.26,;4.06,-.59,;4.83,-1.93,;6.37,-1.93,;7.14,-.59,;6.37,.74,;7.14,2.08,;4.83,.74,;4.06,2.08,)|
OC(=O)c1cccc2[nH]c(nc12)-c1c(F)c(F)c(c(F)c1F)-c1ccccc1F |(-7.14,3.26,;-5.8,2.49,;-4.47,3.26,;-5.8,.95,;-7.14,.18,;-7.14,-1.36,;-5.8,-2.13,;-4.47,-1.36,;-3.01,-1.84,;-2.1,-.59,;-3.01,.65,;-4.47,.18,;-.56,-.59,;.21,.74,;-.56,2.08,;1.75,.74,;2.52,2.08,;2.52,-.59,;1.75,-1.92,;2.52,-3.26,;.21,-1.92,;-.56,-3.26,;4.06,-.59,;4.83,-1.93,;6.37,-1.93,;7.14,-.59,;6.37,.74,;4.83,.74,;4.06,2.08,)|
OC(=O)c1cccc2[nH]c(nc12)-c1ccc(Nc2ccccc2)cc1
OC(=O)c1cccc2[nH]c(nc12)-c1ccc(OCc2ccccc2)cc1
OC(=O)c1cccc2[nH]c(nc12)-c1ccc(Oc2c(F)cccc2F)cc1
OC(=O)c1cccc2[nH]c(nc12)-c1ccc(Oc2ccccc2)cc1
OC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1cccc(F)c1
OC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1cccc(OC(F)(F)F)c1
OC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1cccc(OCc2ccccc2)c1
OC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1cccc2[nH]c(nc12)-c1ccc(cc1)-c1ccccc1F
OC(=O)c1cccc2[nH]c(nc12)-c1cccc(Oc2ccccc2)c1
OC(=O)c1cccc2cc([nH]c12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1cccc2nc([nH]c12)-c1c(F)c(F)c(-c2cccc(F)c2)c(F)c1F
OC(=O)c1cccc2nc([nH]c12)-c1c(F)c(F)c(-c2cccc(OCc3ccccc3)c2)c(F)c1F
OC(=O)c1cccc2nc([nH]c12)-c1c(F)c(F)c(-c2cccs2)c(F)c1F
OC(=O)c1cccc2nc([nH]c12)-c1c(F)c(F)c(c(F)c1F)-c1ccccc1OCc1ccccc1 |(-4.47,1.18,;-5.8,.41,;-7.14,1.18,;-5.8,-1.13,;-7.14,-1.9,;-7.14,-3.44,;-5.8,-4.21,;-4.47,-3.44,;-3.01,-3.91,;-2.1,-2.67,;-3.01,-1.42,;-4.47,-1.9,;-.56,-2.67,;.21,-1.33,;-.56,,;1.75,-1.33,;2.52,,;2.52,-2.67,;1.75,-4,;2.52,-5.33,;.21,-4,;-.56,-5.33,;4.06,-2.67,;4.83,-4,;6.37,-4,;7.14,-2.67,;6.37,-1.33,;4.83,-1.33,;4.06,,;4.83,1.33,;4.06,2.67,;4.83,4,;4.06,5.33,;2.52,5.33,;1.75,4,;2.52,2.67,)|
OC(=O)c1cccc2nc([nH]c12)-c1ccc(cc1)-c1c(F)cccc1F
OC(=O)c1cccc2nc([nH]c12)-c1ccc(cc1F)-c1ccccc1
OC(=O)c1cccc2nc([nH]c12)-c1ccc(cc1F)-c1ccccc1F
OC(=O)c1cccc2nc(oc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1ccccc1N=NCc1ccc(o1)-c1ccccc1Cl |w:10.11|
OC(=O)c1ccccc1NC(=O)Nc1cc(Cl)cc(Cl)c1
OC(=O)c1ccccc1NC(=O)c1ccc(cc1)-c1ccccc1
OC(=O)c1ccccc1NC(=O)c1ccc2cc(Br)ccc2c1
OC(=O)c1ccccc1NC(=O)c1ccc2ccccc2c1
OC(=O)c1ccccc1Nc1ccc(Cl)cc1
OC(=O)c1ccccc1\C=N\Nc1nc(cs1)-c1ccccc1Cl
OC(=O)c1cccn2cc(nc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1cccn2nc(nc12)-c1ccc(cc1)-c1ccccc1
OC(=O)c1cccnc1Nc1c(F)cc(cc1F)-c1cccc(OC2CC2)c1
OC(=O)c1cccnc1Nc1c(F)cc(cc1F)-c1cccc(OC2CCC2)c1
OC(=O)c1cccnc1Nc1ccc(Cl)cc1
OC(=O)c1cccnc1Nc1ccc(F)cc1
OC(=O)c1cccnc1Nc1ccc(OC(F)(F)F)cc1
OC(=O)c1cccnc1Nc1cccc(c1)C(F)(F)F
OC(=O)c1cccnc1Nc1ccccc1
OC(=O)c1cccnc1Oc1ccc(Cl)cc1
OC(=O)c1sccc1C(=O)Nc1c(F)c(F)c(c(F)c1F)-c1cccc(OC(F)(F)F)c1
OC(=O)c1sccc1C(=O)Nc1c(F)cc(cc1F)-c1cccc(OC(F)(F)F)c1
OC1=C(N2CCN(CC2)c2ccc(Cl)cc2)C(=O)c2ccccc2C1=O |c:1|
OC1=C(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc2C1=O |c:1|
OC1=C(N2CCN(CC2)c2cccc(Cl)c2Cl)C(=O)c2ccccc2C1=O |c:1|
OC1=C(N2CCN(CC2)c2ccccc2)C(=O)c2ccccc2C1=O |c:1|
OC1=C(Nc2ccc(Cl)cc2)C(=O)c2ccccc2C1=O |c:1|
OC1=C(Nc2ccc(F)cc2)C(=O)c2ccccc2C1=O |c:1|
OC1=C(Nc2ccc3OCCOc3c2)C(=O)c2ccccc2C1=O |c:1|
OC1=C(Nc2ccc3OCOc3c2)C(=O)c2ccccc2C1=O |c:1|
OC1=C(Nc2cccc(Cl)c2)C(=O)c2ccccc2C1=O |c:1|
OC1=C(Nc2cccc(Cl)c2Cl)C(=O)c2ccccc2C1=O |c:1|
OC1=C(Nc2cccc(c2)C(F)(F)F)C(=O)c2ccccc2C1=O |c:1|
OC1=C(Nc2ccccc2)C(=O)c2ccccc2C1=O |c:1|
OC1=C(Nc2ccccc2Cl)C(=O)c2ccccc2C1=O |c:1|
OC1=CC(=O)c2ccccc2C1=O |t:1|
OC1c2nnn(c2C(O)c2ccccc12)-c1cc(F)c(c(F)c1)-c1ccccc1F |(45.66,-3.01,;45.66,-4.55,;47,-5.33,;48.47,-4.86,;49.38,-6.11,;48.46,-7.36,;46.99,-6.88,;45.65,-7.65,;45.65,-9.19,;44.32,-6.88,;42.98,-7.65,;41.63,-6.87,;41.64,-5.31,;42.98,-4.54,;44.33,-5.32,;48.93,-8.82,;47.9,-9.96,;48.36,-11.42,;47.33,-12.56,;49.87,-11.75,;50.9,-10.6,;52.4,-10.92,;50.43,-9.14,;50.34,-13.21,;49.3,-14.35,;49.77,-15.81,;51.28,-16.13,;52.31,-14.98,;51.84,-13.53,;52.86,-12.38,)|
OCCN(\N=C\c1ccccc1C(O)=O)c1nc(cs1)-c1ccccc1Cl
OCCNC(=O)c1ccc(s1)-n1cnc2ccccc12
OCc1ccc(F)c(c1)-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O |(54.22,-31.73,;53.74,-30.27,;52.24,-29.95,;51.2,-31.1,;49.7,-30.78,;49.23,-29.31,;47.72,-28.99,;50.26,-28.17,;51.76,-28.49,;49.79,-26.71,;48.28,-26.38,;47.25,-27.52,;47.82,-24.92,;48.85,-23.78,;50.35,-24.1,;50.82,-25.56,;52.33,-25.88,;48.38,-22.32,;49.3,-21.07,;48.39,-19.81,;46.92,-20.28,;46.91,-21.83,;45.57,-22.61,;45.57,-24.15,;44.23,-21.83,;42.9,-22.6,;41.57,-21.83,;41.57,-20.29,;42.9,-19.52,;44.23,-20.28,;45.57,-19.5,;45.57,-17.96,)|
OCc1cccc(c1)-c1c(F)cc(cc1F)-n1nnc2c1C(=O)c1ccccc1C2=O
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@H](Cc1ccccc1)NC2=O |r|
O\C(C1CC1)=C(\C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
Oc1c(C#N)c(nc2ccncc12)-c1ccc(cc1)-c1ccccc1OC(F)(F)F
Oc1c(C#N)c(nc2ccncc12)-c1ccc(cc1)-c1cccnc1
Oc1c(C#N)c(nc2ccncc12)-c1ccc(cc1)-c1ccncc1
Oc1c(C#N)c(nc2ccncc12)-c1ccc(cc1)-c1ccncc1Cl
Oc1c(C#N)c(nc2ccncc12)-c1ccc(cc1)-c1cn[nH]c1
Oc1c(C#N)c(nc2ccncc12)-c1ccc(cc1)-c1cncnc1
Oc1ccc(NC(=O)C(C#N)C(=O)C2CC2)cc1
Oc1ccc(\C=N\c2cccc3ccccc23)c(O)c1
Oc1ccc(cc1)\N=C\c1ccc2ccccc2c1
Oc1ccc(cc1O)-c1cc(=O)c2ccccc2o1
Oc1ccc2C(=O)c3c(nnn3-c3cc(F)c(c(F)c3)-c3ccccc3F)C(=O)c2c1 |(18.34,-39.43,;19.67,-40.2,;19.67,-41.74,;21,-42.51,;22.33,-41.75,;23.67,-42.52,;23.67,-44.06,;25.01,-41.75,;25.02,-40.2,;26.49,-39.73,;27.4,-40.98,;26.48,-42.23,;26.95,-43.7,;25.91,-44.84,;26.38,-46.3,;25.35,-47.44,;27.89,-46.63,;28.92,-45.48,;30.43,-45.8,;28.45,-44.02,;28.36,-48.09,;27.32,-49.23,;27.8,-50.69,;29.3,-51.02,;30.33,-49.87,;29.86,-48.41,;30.89,-47.26,;23.67,-39.42,;23.67,-37.88,;22.33,-40.19,;21,-39.43,)|
Oc1ccc2C(=O)c3nnn(c3C(=O)c2c1)-c1cc(F)c(c(F)c1)-c1ccccc1F |(31.44,-42.07,;32.78,-41.3,;32.78,-39.76,;34.11,-38.99,;35.44,-39.75,;36.78,-38.97,;36.78,-37.43,;38.12,-39.75,;39.6,-39.28,;40.51,-40.54,;39.59,-41.79,;38.12,-41.3,;36.77,-42.08,;36.77,-43.62,;35.44,-41.3,;34.11,-42.07,;40.06,-43.25,;39.02,-44.39,;39.49,-45.86,;38.46,-46.99,;40.99,-46.18,;42.03,-45.03,;43.54,-45.36,;41.56,-43.58,;41.47,-47.64,;40.43,-48.78,;40.9,-50.25,;42.41,-50.57,;43.44,-49.42,;42.97,-47.96,;43.99,-46.82,)|
Oc1cccc(c1)-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
Oc1cccc(c1)-n1nnc2c1C(=O)c1ccccc1C2=O
Oc1ccccc1-c1ccc(cc1)-n1nnc2c1C(=O)c1ccccc1C2=O
Oc1csc(Nc2ccc3ccccc3c2)c1C(=O)NC1CC1
Oc1csc(Nc2ccc3ccccc3c2)c1C(=O)NCC1CC1
Oc1nccc2c1C(=O)OC21CCCCC1
Oc1nn2CCCCc2c1C(=O)Nc1c(F)c(F)c(-c2ccccc2)c(F)c1F
Oc1nn2c(Cl)cccc2c1C(=O)Nc1c(F)c(F)c(-c2ccccc2)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2ccc(F)cc2)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2ccc(cc2)C(F)(F)F)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2cccc(F)c2)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2cccc(O)c2)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2cccc(OC(F)(F)F)c2)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2cccc(c2)C(F)(F)F)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2ccccc2)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2cccnc2)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2cccs2)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(-c2ccnc(c2)C(F)(F)F)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1c(F)c(F)c(N2CCOCC2)c(F)c1F
Oc1nn2ccccc2c1C(=O)Nc1ccc(Oc2cccc(c2)C(F)(F)F)cn1
Oc1nn2ccccc2c1C(=O)Nc1ccc(Oc2ccccc2)cc1
Oc1nn2ccccc2c1C(=O)Nc1ccc(Oc2ccccc2)cn1
Oc1nn2ccccc2c1C(=O)Nc1ccc2[nH]ccc2c1
Oc1nn2ccccc2c1C(=O)Nc1ccc2n(ccc2c1)-c1ccccc1
Oc1nn2ccccc2c1C(=O)Nc1ccc2n(cnc2c1)-c1ccccc1
Oc1nn2ccccc2c1C(=O)Nc1ccc2n(nnc2c1)-c1ccccc1
Oc1nonc1C(=O)NCC(c1ccccc1)c1ccccc1
Oc1nsnc1C(=O)NCC(c1ccccc1)c1ccccc1
Oc1nsnc1C(=O)NCc1ccccc1
S=C(Nc1ccc(cc1)C#N)c1cnoc1C1CC1
S=C(Nc1ccc(cc1)C#N)c1cnoc1C1CCCCC1
[#6]-[#6]-[#8]-[#6](=O)-[#6](=[#6]/[#7]-c1ccc2sc3ccccc3c2c1)\[#6](=O)-[#8]-[#6]-[#6]
[#6]\[#6](-[#6])=[#6]/[#6]-[#6]-1-[#6](=O)-[#6](=O)-c2ccccc2-[#6]-1=O
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-1=[#6](-[#8]-[#6]C#N)-[#6](=O)-c2ccccc2-[#6]-1=O |c:5|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-1=[#6](-[#8]S(=O)(=O)c2ccc(-[#6])cc2)-[#6](=O)-c2ccccc2-[#6]-1=O |c:5|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])cc2)c1-[#8]
[#8]-[#6]-1=[#6](-[#6]\[#6]=[#6](\Cl)Cl)-[#6](=O)-c2ccccc2-[#6]-1=O |c:1|
[H][C@@]1(CC\C(C)=C\CC\C(C)=C\Cc2c(O)c(Cl)c(C)c(C=O)c2O)OC1(C)C |r|
[H][C@@]1(Cc2c(O1)c(Cl)c(C)c(C=O)c2O)[C@@](C)(O)\C=C\[C@@]1(C)[C@H](C)CCC(=O)[C@@H]1C |r|
[H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@]4(C)OO[C@@]13[C@]([H])(OC(=O)[C@@H]2C)O4
[H][C@]1(CC(=O)C(C)(C)O1)C(\C)=C\CC\C(C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O |r|
[H][C@]1(Cc2c(O)c(Cl)c(C)c(C=O)c2O)[C@](C)(O)CC[C@@]2([H])C(C)(C)[C@@H](O)CC[C@]12C |r|
[I+](c1ccccc1)c1ccccc1
[I+]1c2ccccc2-c2ccccc12
[Li;v0+].[#6]-[#6]-[#8]-c1cccc(c1)-c1ccc(-[#7]-c2cnccc2-[#6](-[#8-])=O)c(F)c1
[Li;v0+].[#6]-[#8]-c1cccc(c1)-c1ccc(-[#7]-c2cnccc2-[#6](-[#8-])=O)c(-[#8]C(F)(F)F)c1
[Li;v0+].[#8-]-[#6](=O)-c1ccncc1-[#7]-c1ccc(cc1F)-c1cccc(-[#8]C(F)(F)F)c1
[Li]OC(=O)c1ccncc1Nc1ccc(cc1F)-c1cccc(OC(F)(F)F)c1
[Li]OC(=O)c1ccncc1Nc1ccc(cc1F)-c1cccc(OCC)c1
[Li]OC(=O)c1ccncc1Nc1ccc(cc1OC(F)(F)F)-c1cccc(OC)c1
[Na;v0+].[#6]\[#6](-[#6])=[#6]/[#6]-[#6]-1=[#6](-[#8-])-[#6](=O)-c2ccccc2-[#6]-1=O |c:5|
[O-]C(=O)c1c2CCc3c(Oc4ccccc4)cccc3-c2nc2ccc(F)cc12
[O-]C(=O)c1c2CCc3c(cccc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2CCc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccc(cc1)C(F)(F)F
[O-]C(=O)c1c2CCc3cc(ccc3-c2nc2ccc(F)cc12)-c1cccc(c1)C(F)(F)F
[O-]C(=O)c1c2CCc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2CCc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1C(F)(F)F
[O-]C(=O)c1c2CCc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1F
[O-]C(=O)c1c2CCc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccoc1
[O-]C(=O)c1c2CCc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccsc1
[O-]C(=O)c1c2CCc3cc(ccc3-c2nc2ccc(F)cc12)-c1nccs1
[O-]C(=O)c1c2CCc3cc(ccc3-c2nc2ccc(cc12)C(F)(F)F)-c1ccccc1
[O-]C(=O)c1c2CCc3cc(sc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2CCc3ccc(cc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2CCc3nc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2CCc3nc(ncc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2COc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2CS(=O)(=O)c3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2CS(=O)c3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2CSc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2OCc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-]C(=O)c1c2SCc3cc(ccc3-c2nc2ccc(F)cc12)-c1ccccc1
[O-][N+](=O)C(=C=[N-])C(=O)Nc1ccc(cc1)-c1ccccc1
[O-][N+](=O)C(=C=[N-])C(=O)Nc1ccc(cc1)C(F)(F)F
[O-][N+](=O)C(=C=[N-])C(=O)Nc1ccc(cc1)[N+]([O-])=O
[O-][N+](=O)c1ccc(NC(=O)C(=C=[N-])C(=[OH+])C2CC2)cc1
c1cc(sc1-c1nc2ccccc2[nH]1)-c1nc2ccccc2[nH]1
c1cc(sc1-c1nc2ccccc2o1)-c1nc2ccccc2o1